1-cyclohexylpiperidine-4-carboxylic acid | 897094-33-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-cyclohexylpiperidine-4-carboxylic acid
• 英文别名: 1-Cyclohexylpiperidin-1-ium-4-carboxylate
• CAS: 897094-33-6
• 化学式: C₁₂H₂₁NO₂
• mdl: MFCD06800481
• 分子量: 211.304
• InChiKey: QTJYMJZSIMYYLB-UHFFFAOYSA-N

物化性质

• 沸点：
  343.1±35.0 °C(Predicted)
• 密度：
  1.112±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  44.6
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 危险等级：
  IRRITANT

文献信息

• [EN] NEW TETRACYCLINE DERIVATIVES AS ANTIINFECTIVE AGENTS<br/>[FR] NOUVEAU DÉRIVÉS DE TÉTRACYCLINE EN TANT QU'AGENTS ANTI-INFECTIEUX
  申请人：REDDYS LAB LTD DR

  公开号：WO2009032326A1

  公开（公告）日：2009-03-12

  In accordance with one embodiment, the present invention provides a compound of general formula (I), stereoisomers thereof and/or its pharmaceutically acceptable salts thereof, which have antibacterial activity; with methods of treating infectious diseases in warm blooded animals employing these new compounds.

  根据一种实施例，本发明提供了通式（I）的化合物，其立体异构体和/或其药学上可接受的盐，具有抗菌活性；采用这些新化合物治疗温血动物感染性疾病的方法。
• RHO KINASE INHIBITORS
  申请人：Bosanac Todd

  公开号：US20080161297A1

  公开（公告）日：2008-07-03

  Disclosed are novel substituted 2H-isoquinolin-1-one and 3H-quinazolin-4-one derivatives useful as inhibitors of Rho kinase and for treating a variety of diseases and disorders that are mediated or sustained through the activity of Rho kinase, including cardiovascular diseases, pharmaceutical compositions comprising such compounds, methods for using such compounds and processes for making such compounds.

  揭示了一种新颖的取代的2H-异喹啉-1-酮和3H-喹唑啉-4-酮衍生物，可用作Rho激酶的抑制剂，用于治疗通过Rho激酶活性介导或维持的各种疾病和疾病，包括心血管疾病，包含这些化合物的药物组合物，使用这些化合物的方法以及制备这些化合物的方法。
• [EN] (3 -METHYLPYRROLIDIN- 3 - YL) METHYL PYRIDINYL ETHER DERIVATIVES AND THEIR USE AS NK-3 RECEPTOR ANTAGONISTS<br/>[FR] DÉRIVÉS DE (3-MÉTHYLPYRROLIDINE-3-YL) MÉTHYL PYRIDINYLE ÉTHER ET LEUR UTILISATION COMME ANTAGONISTES DU RÉCEPTEUR NK-3
  申请人：HOFFMANN LA ROCHE

  公开号：WO2012004207A1

  公开（公告）日：2012-01-12

  The invention relates to a compound of general formula : (I) wherein A is selected from the groups (a), (b) or (c): formula (II) or formula (III) (b) or is cycloalkyl, (c) optionally substituted by lower alkyl (c);Ar1 is phenyl or a six membered heteroaryl;X1 is N or CH; X2 is N-R1 or O; R1 is S(O)2-lower alkyl, C(O)-cycloalkyl substituted by lower alkyl, or is C(O)-lower alkyl, lower alkyl, cyano, cycloalkyl or is a six membered heteroaryl substituted by lower alkyl, cyano, C(O)-lower alkyl, halogen, lower alkyl substituted by halogen or lower alkoxy; or is phenyl substituted by cyano or halogen; R2 is lower alkyl, halogen, pyrazolyl, 3-methyl-[1,2,4]oxazolyl, 5-methyl-[1,2,4]oxadiazol-3-yl, pyridyl substituted by cyano, or is phenyl substituted by halogen, or is cyano, lower alkoxy, or is piperidin-2-one; or to pharmaceutically active salts, sterioisomeric forms, including individual diastereoisomers and enantiomers of the compound of formula I as well as racemic and non-racemic mixtures thereof..It has been found that the present compounds are high potential NK-3 receptor antagonists for the treatment of depression, pain, psychosis, Parkinsons disease, schizophrenia, anxiety and attention deficit hyperactivity disorder (ADHD).

  该发明涉及一般式(I)的化合物，其中A选自(a)、(b)或(c)组：式(II)或式(III) (b)或是环烷基，(c)可选择由较低烷基取代的环烷基；Ar1是苯或六元杂环烷基；X1是N或CH；X2是N-R1或O；R1是S(O)2-较低烷基，C(O)-环烷基取代的较低烷基，或是C(O)-较低烷基，较低烷基，氰基，环烷基或是由较低烷基，氰基，C(O)-较低烷基，卤素，由卤素取代的较低烷基或较低烷氧基取代的六元杂环烷基；或是由氰基或卤素取代的苯；R2是较低烷基，卤素，吡唑基，3-甲基-[1,2,4]噁唑基，5-甲基-[1,2,4]噁二唑-3-基，由氰基取代的吡啶基，或是由卤素取代的苯，或是氰基，较低烷氧基，或是哌啶-2-酮；或是药用盐，立体异构体形式，包括一般式I化合物的各个对映体和对映异构体以及它们的混合物。已发现这些化合物是高潜力的NK-3受体拮抗剂，用于治疗抑郁症、疼痛、精神病、帕金森病、精神分裂症、焦虑症和注意力缺陷多动障碍（ADHD）。
• METHYL-PYRROLIDINE ETHER DERIVATIVES
  申请人：Nettekoven Matthias

  公开号：US20120010212A1

  公开（公告）日：2012-01-12

  The invention relates to a compound of formula wherein A is defined herein or to pharmaceutically active salts, stereoisomeric forms, including individual diastereoisomers and enantiomers of the compound of formula I as well as racemic and non-racemic mixtures thereof. The present compounds are high potential NK-3 receptor antagonists for the treatment of depression, pain, psychosis, Parkinson's disease, schizophrenia, anxiety and attention deficit hyperactivity disorder (ADHD).

  该发明涉及一种具有以下化学式的化合物，其中A在此处被定义，或者是药用活性盐、立体异构体形式，包括化合物I的各个对映异构体和对映体，以及它们的混合物。目前的化合物是治疗抑郁症、疼痛、精神病、帕金森病、精神分裂症、焦虑和注意力缺陷多动障碍（ADHD）的高潜力NK-3受体拮抗剂。
• [EN] PYRROLIDINE DERIVATIVES AS NK3 ANTAGONISTS<br/>[FR] DÉRIVÉS DE PYRROLIDINE EN TANT QU'ANTAGONISTES DE NK3
  申请人：HOFFMANN LA ROCHE

  公开号：WO2012093109A1

  公开（公告）日：2012-07-12

  The invention relates to compounds of formula (I) wherein R1 is (A), or is phenyl, pyridinyl or pyridazinyl, wherein phenyl, pyridinyl and pyridazinyl may optionally be substituted by cyano, lower alkyl, halogen-substituted phenyl, lower alkyl-substituted [1,2,4]oxadiazol-3-yl or by 2-oxo-piperidin-1-yl; X is NR or O; R is C(O)-lower alkyl, -C(O)-cycloalkyl substituted by lower alkyl, cycloalkyl or is phenyl, pyridinyl or pyridazinyl, wherein phenyl, pyridinyl and pyridazinyl may optionally be substituted by lower alkyl, lower alkoxy, cyano, -C(O)-lower alkyl, halogen or lower alkyl substituted by halogen; R2 is hydrogen or lower alkyl; R3 is hydrogen, halogen, cyano, lower alkyl or lower alkyl substituted by halogen; R4 is hydrogen or lower alkyl; wherein R2 and R4 are not simultaneously hydrogen or lower alkyl; R5 is lower alkyl; R6 halogen, hydroxy, lower alkyl, lower alkoxy, lower alkyl substituted by halogen, S(O)2-lower alkyl or cyano; or to a pharmaceutically suitable acid addition salt thereof. It has been found that the present compounds are high potential NK-3 receptor antagonists for the treatment of depression, pain, psychosis, Parkinson's disease, schizophrenia, anxiety and attention deficit hyperactivity disorder (ADHD).

  本发明涉及化合物式（I）的化合物，其中R1为（A），或为苯基，吡啶基或吡嗪基，其中苯基，吡啶基和吡嗪基可以选择性地被氰基，低烷基，卤代苯基，低烷基取代的[1,2,4]噁二唑-3-基或2-氧代哌啶-1-基取代；X为NR或O；R为C（O）-低烷基，-C（O）-环烷基，环烷基取代低烷基，环烷基或为苯基，吡啶基或吡嗪基，其中苯基，吡啶基和吡嗪基可以选择性地被低烷基，低烷氧基，氰基，-C（O）-低烷基，卤素或低烷基取代的卤素取代；R2为氢或低烷基；R3为氢，卤素，氰基，低烷基或低烷基取代的卤素；R4为氢或低烷基；其中R2和R4不同时为氢或低烷基；R5为低烷基；R6为卤素，羟基，低烷基，低烷氧基，低烷基取代的卤素，S（O）2-低烷基或氰基；或其药学上适宜的酸加成盐。已发现，本化合物是治疗抑郁症，疼痛，精神病，帕金森病，精神分裂症，焦虑症和注意力缺陷多动障碍（ADHD）的高潜力NK-3受体拮抗剂。