2-(苯基甲基)环己烷-1-胺 | 72436-51-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 2-(苯基甲基)环己烷-1-胺
• 英文名称: 2-benzylcyclohexylamine
• 英文别名: 2-benzylcyclohexanamine；2-(benzylidenyl)cyclohexylamine；1-amino-2-benzylcyclohexane；2-benzylcyclohexan-1-amine
• CAS: 72436-51-2
• 化学式: C₁₃H₁₉N
• 分子量: 189.301
• InChiKey: YOPIHDSNQOMRGC-UHFFFAOYSA-N

物化性质

• 沸点：
  289.9±9.0 °C(Predicted)
• 密度：
  0.984±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2921499090

反应信息

• 作为反应物：
  描述：

  2-(苯基甲基)环己烷-1-胺 在 吡啶 、 silver(I) acetate 、 palladium diacetate 、 对苯醌 作用下， 以 1,4-二氧六环 、 乙腈 为溶剂， 反应 36.0h， 生成 (4aS*,11aS*)-5-(pyridin-2-ylsulfonyl)-3,4,4a,5,11,11a-hexahydro-1H-dibenzo[b,e]azepin-6(2H)-one
  参考文献：
  名称：

  Access to Benzazepinones by Pd-Catalyzed Remote C–H Carbonylation of γ-Arylpropylamine Derivatives

  摘要：

  A general method for the construction of seven-membered rings through Pd-catalyzed C(sp(2))-H carbonylation at the remote epsilon-position of gamma-arylpropylamine derivatives, including chiral alpha-amino acids, has been developed using Mo(CO)(6) as the CO source, furnishing richly functionalized benzo[c]azepin-1-one derivatives. The readily removable N-SO2Py protecting/directing group provides high levels of chemo-, regio- and diastereoselectivity. Furthermore, this method is amenable to the postsynthetic modification of complex molecules such as small peptides.

  DOI：

  10.1021/acs.orglett.9b01523
• 作为产物：
  描述：

  2-苄基环己酮 在 lithium aluminium tetrahydride 、 盐酸羟胺 、 sodium acetate 作用下， 以 四氢呋喃 、 乙醇 、 水 为溶剂， 反应 16.0h， 生成 2-(苯基甲基)环己烷-1-胺
  参考文献：
  名称：

  Access to Benzazepinones by Pd-Catalyzed Remote C–H Carbonylation of γ-Arylpropylamine Derivatives

  摘要：

  A general method for the construction of seven-membered rings through Pd-catalyzed C(sp(2))-H carbonylation at the remote epsilon-position of gamma-arylpropylamine derivatives, including chiral alpha-amino acids, has been developed using Mo(CO)(6) as the CO source, furnishing richly functionalized benzo[c]azepin-1-one derivatives. The readily removable N-SO2Py protecting/directing group provides high levels of chemo-, regio- and diastereoselectivity. Furthermore, this method is amenable to the postsynthetic modification of complex molecules such as small peptides.

  DOI：

  10.1021/acs.orglett.9b01523

文献信息

• Urea derivatives useful as anticancer agents
  申请人：——

  公开号：US20030191279A1

  公开（公告）日：2003-10-09

  The present invention relates to compounds of formula I 1 And to pharmaceutically acceptable salts, hydrates and prodrugs thereof, wherein R 1 , R 2 , R 3 , R 4 , R 5 , R 10 , R 11 , b, m, n, p and v are as defined herein. The invention also relates to pharmaceutical compositions containing the above compounds and methods of treating hyperproliferative disorders in mammals by administering the above compounds.

  本发明涉及式I1的化合物及其药用可接受的盐、水合物和前药，其中R1、R2、R3、R4、R5、R10、R11、b、m、n、p和v如本文所定义。该发明还涉及含有上述化合物的药物组合物以及通过给予上述化合物来治疗哺乳动物的过度增殖性疾病的方法。
• 2-(Phenylmethylene)cycloalkylamines and -azetidines
  申请人：The Upjohn Company

  公开号：US04540690A1

  公开（公告）日：1985-09-10

  2-(Phenylmethylene)cycloalkylamines and -azetidines of the formula ##STR1## and acid addition salts thereof, e.g., 1-[2-(phenylmethylene)cyclohexyl]azetidine, and related compounds, which have analgesic, antidepressant and mixed analgesic/antidepressant central nervous system (CNS) activities, and which are useful in treating pain and/or depression in mammals including humans. The invention provides processes for preparing the compounds as well as compositions containing the compounds and methods for using the compounds as analgesic and/or antidepressant drugs for humans and valuable mammalian animals.

  本发明涉及公式##STR1##的2-(苯亚甲基)环烷胺和-氮杂环己烷化合物及其酸加成盐，例如1-[2-(苯亚甲基)环己基]氮杂环己烷和相关化合物。这些化合物具有镇痛、抗抑郁和镇痛/抗抑郁的中枢神经系统(CNS)活性，并且对于治疗哺乳动物包括人类的疼痛和/或抑郁症是有用的。本发明提供了制备这些化合物的方法，以及含有这些化合物的组合物和将这些化合物用作人类和有价值的哺乳动物的镇痛和/或抗抑郁药物的方法。
• Biaryl compounds useful as anticancer agents
  申请人：Pfizer Inc

  公开号：US06576632B1

  公开（公告）日：2003-06-10

  The present invention relates to compounds of formula I and to pharmaceutically acceptable salts, hydrates and prodrugs thereof, wherein R1, R2, R3, R4, R5, R10, R11, b, m, n, p and v are as defined herein. The invention also relates to pharmaceutical compositions containing the above compounds and methods of treating hyperproliferative disorders in mammals by administering the above compounds.

  本发明涉及式I的化合物及其药学上可接受的盐、水合物和前药，其中R1、R2、R3、R4、R5、R10、R11、b、m、n、p和v如本文所定义。本发明还涉及包含上述化合物的制药组合物以及通过给予上述化合物治疗哺乳动物的增殖过多性疾病的方法。
• AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES
  申请人：Komori Takashi

  公开号：US20100105647A1

  公开（公告）日：2010-04-29

  Disclosed is an amide compound represented by the following formula (1). (1) (In the formula, X 1 represents a fluorine atom or a methoxy group; X 2 represents a hydrogen atom, a halogen atom, a C 1 -C 4 alkyl group or the like; Z represents an oxygen atom or a sulfur atom; and A represents an A 1 -CR 6 R 7 R 8 group, an A 2 -Cy 1 group or an A 3 -Cy 2 group, wherein A 1 represents a CH 2 group or the like, A 2 represents a single bond, a CH 2 group or the like, Cy 1 represents a C 3 -C 6 cycloalkyl group substituted with a C 1 -C 6 alkoxy group or the like, Cy 2 represents a C 3 -C 6 cycloalkyl group which may be substituted with at least one halogen atom or the like, R 6 and R 7 independently represent a C 1 -C 4 alkyl group, and R 8 represents a halogen atom, a hydroxyl group or the like.) The amide compound has excellent plant disease controlling activity.

  本发明涉及一种由以下式（1）表示的酰胺化合物。（1）（在该式中，X1表示氟原子或甲氧基；X2表示氢原子，卤素原子，C1-C4烷基或类似物；Z表示氧原子或硫原子；A表示A1-CR6R7R8基团，A2-Cy1基团或A3-Cy2基团，其中A1表示CH2基团或类似物，A2表示单键，CH2基团或类似物，Cy1表示C3-C6环烷基取代的C1-C6烷氧基或类似物，Cy2表示C3-C6环烷基，可以用至少一个卤素原子或类似物取代，R6和R7独立地表示C1-C4烷基，R8表示卤素原子，羟基或类似物。）该酰胺化合物具有出色的植物病害控制活性。
• LIGAND COMPOUND, CATALYST SYSTEM FOR OLEFIN OLIGOMERIZATION, AND OLEFIN OLIGOMERIZATION METHOD USING SAME
  申请人：LG Chem, Ltd.

  公开号：EP3214087A1

  公开（公告）日：2017-09-06

  The present invention relates to a ligand compound, a catalyst system for olefin oligomerization, and a method for oligomerizing olefins using the same. The ligand compound according to the present invention has a structure in which a substituent is substituted in the trans form, and thereby when used for olefin oligomerization, the activity of the catalyst used and the selectivity of 1-hexene and 1-octene can be increased.

  本发明涉及一种配体化合物、一种用于烯烃低聚的催化剂体系，以及一种用其低聚烯烃的方法。根据本发明的配体化合物具有以反式形式取代一个取代基的结构，因此当用于烯烃低聚时，所用催化剂的活性和 1-己烯和 1-辛烯的选择性可以提高。