trans-N-benzyl-4-phenylcyclohexan-1-amine | 28151-46-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: trans-N-benzyl-4-phenylcyclohexan-1-amine
• 英文别名: trans-4-fenil-N-benzilcicloesilammina；N-benzyl-4-phenylcyclohexan-1-amine；trans-N-Benzyl-4-phenyl-cyclohexylamin；trans-Benzyl-4-phenylcyclohexylamin
• CAS: 28151-46-4
• 化学式: C₁₉H₂₃N
• 分子量: 265.398
• InChiKey: VUAXLQTVMNSPPT-WGSAOQKQSA-N

物化性质

• 沸点：
  399.9±31.0 °C(Predicted)
• 密度：
  1.04±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  20.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  12.03
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  trans-N-benzyl-4-phenylcyclohexan-1-amine 在 盐酸 、 palladium on activated charcoal 、 溶剂黄146 、 三乙胺 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 、 水 为溶剂， 反应 34.0h， 生成 3-(5-hydroxypyridin-2-yl)-1-[(1r,4r)-4-phenylcyclohexyl]urea
  参考文献：
  名称：

  [EN] INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE
  [FR] INHIBITEURS DE LA DIHYDROCÉRAMIDE DÉSATURASE POUR LE TRAITEMENT D'UNE MALADIE

  摘要：

  本文披露了二氢神经酰胺脱饱和酶1（Des1）抑制剂化合物和组合物，这些化合物和组合物在治疗疾病方面非常有用，例如代谢紊乱，预期通过抑制Des1对患者具有治疗作用。还提供了在人类或动物受试者中抑制Des1活性的方法。

  公开号：

  WO2019140188A1
• 作为产物：
  描述：

  trans-phenyl-4 cyclohexylamine 在 sodium tetrahydroborate 作用下， 以 甲醇 、 水 为溶剂， 生成 trans-N-benzyl-4-phenylcyclohexan-1-amine
  参考文献：
  名称：

  Cantarelli; Carissimi; D'Ambrosio, Farmaco, Edizione Scientifica, 1970, vol. 25, # 4, p. 248 - 294

  摘要：

  DOI：

文献信息

• Hydride reagents for stereoselective reductive amination. An improved preparation of 3-endo-tropanamine
  作者：John M. McGill、Elizabeth S. Labell、MaryAnn Williams

  DOI：10.1016/0040-4039(96)00760-5

  日期：1996.6

  The reductive amination of substituted cyclohexanones with sodium triacyloxy-borohydrides derived from NaBH4 and various carboxylic acids provides highly diastereoselective conversions to protected axial amines. This method was applied to the stereoselective preparation of 3-endo-tropanamine.

  用衍生自NaBH 4和各种羧酸的三酰氧基硼氢化钠对取代的环己酮进行还原性胺化反应，可高度非对映选择性地转化为受保护的轴向胺。该方法用于3-内-三聚泛胺的立体选择性制备。
• Cyclohexyl(alkyl)-propanolamines, preparation method and pharmaceutical compositions containing same
  申请人：——

  公开号：US20040053916A1

  公开（公告）日：2004-03-18

  The present invention relates to the compounds of formula (I): 1 in which A is a group of formula (a) or (b) 2 in which R represents a hydrogen or halogen atom, an —S(O) z (C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —SO 2 NH(C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl group or an —NHSO 2 phenyl group, said phenyl possibly being substituted with a halogen atom, with a (C 1 -C 4 )alkyl group or with a (C 1 -C 4 )alkoxy group; R 1 represents a hydrogen atom or a (C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, a phenyl-(C 1 -C 4 )alkyl group or a —COphenyl group, said phenyl also possibly being substituted with a halogen atom or with a (C 1 -C 4 )alkoxy group; R 2 is a hydrogen atom or an —SO 2 (C 1 -C 4 )alkyl group, an —SO 2 phenyl-(C 1 -C 4 )alkyl group or an —SO 2 phenyl group; X completes a ring of 5 to 8 atoms, said ring being saturated or unsaturated, possibly being substituted with one or two (C 1 -C 4 )alkyl groups and bearing one or two carbonyl groups; n, m and z are, independently, 0, 1 or 2; R 3 represents a hydrogen or halogen atom, a (C 1 -C 6 )alkyl group, a (C 1 -C 4 )alkoxy group, a —COO(C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl groups, —NO 2 , —CN, —CONR 4 R 5 , —COOH, or a 4,5-dihydro-1,3-oxazol-2-yl or 4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl group; R 4 and R 5 represent, independently, a hydrogen atom, a phenyl, a (C 1 -C 4 )alkyl group or a phenyl-(C 1 -C 4 )alkyl group or R 4 and R 5 with the nitrogen atom to which they are attached, may form a ring of 5 to 7 atoms in total; and to the salts or solvates thereof, to the pharmaceutical compositions containing them, to a process for the preparation thereof and to intermediates in this process.

  本发明涉及以下公式（I）的化合物： 其中，A是公式（a）或（b）的基团； 其中，R表示氢或卤素原子、—S（O）z（C1-C4）烷基、—NHSO2（C1-C4）烷基、—SO2NH（C1-C4）烷基、—NHSO2苯基-(C1-C4)烷基或—NHSO2苯基，所述苯可能被卤素原子、(C1-C4)烷基或(C1-C4)氧烷基取代； R1表示氢原子或(C1-C4)烷基、—CO（C1-C4）烷基、苯基-(C1-C4)烷基或—CO苯基，所述苯也可能被卤素原子或(C1-C4)氧烷基取代； R2是氢原子或—SO2（C1-C4）烷基、—SO2苯基-(C1-C4)烷基或—SO2苯基； X完成5至8个原子的环，该环饱和或不饱和，可能被一个或两个(C1-C4)烷基取代，并带有一个或两个羰基基团； n，m和z独立地为0，1或2； R3表示氢或卤素原子、(C1-C6)烷基、(C1-C4)氧烷基、—COO（C1-C4）烷基、—CO（C1-C4）烷基、—NHSO2（C1-C4）烷基、—NHSO2苯基-(C1-C4)烷基、—NO2、—CN、—CONR4R5、—COOH或4,5-二氢-1,3-噁唑-2-基或4,4-二甲基-4,5-二氢-1,3-噁唑-2-基； R4和R5独立地表示氢原子、苯基、(C1-C4)烷基或苯基-(C1-C4)烷基，或R4和R5与它们所连接的氮原子可以总共形成5至7个原子的环；以及其盐或溶剂化物、含有它们的制药组合物、制备它们的过程和该过程中的中间体。
• CYCLOHEXYL(ALKYL)PROPANOLAMINES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME
  申请人：Bovy Philippe R.

  公开号：US20080261949A1

  公开（公告）日：2008-10-23

  The present invention relates to the compounds of formula (I): in which A is a group of formula (a) or (b) in which R represents a hydrogen or halogen atom, an —S(O) z (C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —SO 2 NH(C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl group or an —NHSO 2 phenyl group, said phenyl possibly being substituted with a halogen atom, with a (C 1 -C 4 )alkyl group or with a (C 1 -C 4 )alkoxy group; R 1 represents a hydrogen atom or a (C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, a phenyl-(C 1 -C 4 )alkyl group or a —COphenyl group, said phenyl also possibly being substituted with a halogen atom or with a (C 1 -C 4 )alkoxy group; R 2 is a hydrogen atom or an —SO 2 (C 1 -C 4 )alkyl group, an —SO 2 phenyl-(C 1 -C 4 )alkyl group or an —SO 2 phenyl group; X completes a ring of 5 to 8 atoms, said ring being saturated or unsaturated, possibly being substituted with one or two (C 1 -C 4 )alkyl groups and bearing one or two carbonyl groups; n, m and z are, independently, 0, 1 or 2; R 3 represents a hydrogen or halogen atom, a (C 1 -C 6 )alkyl group, a (C 1 -C 4 )alkoxy group, a —COO(C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl groups, —NO 2 , —CN, —CONR 4 R 5 , —COOH, or a 4,5-dihydro-1,3-oxazol-2-yl or 4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl group; R 4 and R 5 represent, independently, a hydrogen atom, a phenyl, a (C 1 -C 4 )alkyl group or a phenyl-(C 1 -C 4 )alkyl group or R 4 and R 5 with the nitrogen atom to which they are attached, may form a ring of 5 to 7 atoms in total; and to the salts or solvates thereof, to the pharmaceutical compositions containing them, to a process for the preparation thereof and to intermediates in this process.

  本发明涉及公式（I）的化合物： 其中A是公式（a）或（b）的基团： 其中R表示氢或卤素原子，-S（O）z（C1-C4）烷基，-NHSO2（C1-C4）烷基，-SO2NH（C1-C4）烷基，-NHSO2苯基-（C1-C4）烷基或-NHSO2苯基，所述苯基可能被卤素原子，（C1-C4）烷基或（C1-C4）氧烷基取代； R1表示氢原子或（C1-C4）烷基，-CO（C1-C4）烷基，苯基-（C1-C4）烷基或-CO苯基，所述苯基也可能被卤素原子或（C1-C4）氧烷基取代； R2是氢原子或-SO2（C1-C4）烷基，-SO2苯基-（C1-C4）烷基或-SO2苯基； X完成由5到8个原子组成的环，该环饱和或不饱和，可能被一个或两个（C1-C4）烷基取代，并带有一个或两个羰基基团； n，m和z独立地为0、1或2； R3表示氢或卤素原子，（C1-C6）烷基，（C1-C4）氧烷基，-COO（C1-C4）烷基，-CO（C1-C4）烷基，-NHSO2（C1-C4）烷基，-NHSO2苯基-（C1-C4）烷基，-NO2，-CN，-CONR4R5，-COOH或4,5-二氢-1,3-噁唑-2-基或4,4-二甲基-4,5-二氢-1,3-噁唑-2-基； R4和R5独立地表示氢原子，苯基，（C1-C4）烷基或苯基-（C1-C4）烷基，或R4和R5与它们附着的氮原子一起可以形成总共5到7个原子的环；以及其盐或溶剂，含有它们的制药组合物，制备过程和其中间体的本发明。
• Cyclohexyl(alkyl)propanolamines, Preparation Method and Pharmaceutical Compositions Containing Same
  申请人：BOVY R. Philippe

  公开号：US20070015745A1

  公开（公告）日：2007-01-18

  The present invention relates to the compounds of formula (I): in which A is a group of formula (a) or (b) in which R represents a hydrogen or halogen atom, an —S(O) z (C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —SO 2 NH(C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl group or an —NHSO 2 phenyl group, said phenyl possibly being substituted with a halogen atom, with a (C 1 -C 4 )alkyl group or with a (C 1 -C 4 )alkoxy group; R 1 represents a hydrogen atom or a (C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, a phenyl-(C 1 -C 4 )alkyl group or a —CO—phenyl group, said phenyl also possibly being substituted with a halogen atom or with a (C 1 -C 4 )alkoxy group; R 2 is a hydrogen atom or an —SO 2 (C 1 -C 4 )alkyl group, an —SO 2 phenyl-(C 1 -C 4 )alkyl group or an —SO 2 phenyl group; X completes a ring of 5 to 8 atoms, said ring being saturated or unsaturated, possibly being substituted with one or two (C 1 -C 4 )alkyl groups and bearing one or two carbonyl groups; n, m and z are, independently, 0, 1 or 2; R 3 represents a hydrogen or halogen atom, a (C 1 -C 6 )alkyl group, a (C 1 -C 4 )alkoxy group, a —COO(C 1 -C 4 )alkyl group, a —CO(C 1 -C 4 )alkyl group, an —NHSO 2 (C 1 -C 4 )alkyl group, an —NHSO 2 phenyl-(C 1 -C 4 )alkyl groups, —NO 2 , —CN, —CONR 4 R 5 , —COOH, or a 4,5-dihydro-1,3-oxazol-2-yl or 4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl group; R4 and R 5 represent, independently, a hydrogen atom, a phenyl, a (C 1 -C 4 )alkyl group or a phenyl-(C 1 -C 4 )alkyl group or R 4 and R 5 with the nitrogen atom to which they are attached, may form a ring of 5 to 7 atoms in total; and to the salts or solvates thereof, to the pharmaceutical compositions containing them, to a process for the preparation thereof and to intermediates in this process.

  本发明涉及式(I)的化合物： 其中，A是式(a)或(b)的基团： 其中，R代表氢或卤素原子，-S(O)z(C1-C4)烷基，-NHSO2(C1-C4)烷基，-SO2NH(C1-C4)烷基，-NHSO2苯基-(C1-C4)烷基或-NHSO2苯基，所述苯可能被卤素原子，(C1-C4)烷基或(C1-C4)氧代基取代；R1代表氢原子或(C1-C4)烷基，-CO(C1-C4)烷基，苯基-(C1-C4)烷基或-CO-苯基，所述苯也可能被卤素原子或(C1-C4)氧代基取代；R2是氢原子或-SO2(C1-C4)烷基，-SO2苯基-(C1-C4)烷基或-SO2苯基；X完成一个由5到8个原子组成的环，该环饱和或不饱和，可能被一个或两个(C1-C4)烷基取代，并带有一个或两个羰基基团；n，m和z独立地为0，1或2；R3代表氢或卤素原子，(C1-C6)烷基，(C1-C4)氧代基，-COO(C1-C4)烷基，-CO(C1-C4)烷基，-NHSO2(C1-C4)烷基，-NHSO2苯基-(C1-C4)烷基，-NO2，-CN，-CONR4R5，-COOH或4,5-二氢-1,3-噁唑-2-基或4,4-二甲基-4,5-二氢-1,3-噁唑-2-基；R4和R5独立地代表氢原子，苯基，(C1-C4)烷基或苯基-(C1-C4)烷基，或R4和R5与它们所连接的氮原子可以总共形成一个由5到7个原子组成的环；以及它们的盐或溶剂合物，含有它们的制药组合物，制备它们的过程以及在该过程中的中间体。
• BICYCLIC ARYL AND HETEROARYL COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS
  申请人：Bloxham Jason

  公开号：US20100173886A1

  公开（公告）日：2010-07-08

  Compounds of formula (I): or pharmaceutically acceptable salts thereof, are opioid receptor modulators, e.g. mu-opioid receptor antagonists, neutral antagonists or inverse agonists, and are useful for the treatment of metabolic disorders including obesity.

  化合物式(I)或其药学上可接受的盐，是阿片受体调节剂，例如μ-阿片受体拮抗剂，中性拮抗剂或倒向激动剂，并且可用于治疗代谢性疾病，包括肥胖症。