1-[6-(Cyclohexylmethyl)pyridin-2-yl]piperazine | 120145-35-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 1-[6-(Cyclohexylmethyl)pyridin-2-yl]piperazine
• CAS: 120145-35-9
• 化学式: C₁₆H₂₅N₃
• 分子量: 259.395
• InChiKey: RVYSFDSBHGXYDX-UHFFFAOYSA-N

物化性质

• 沸点：
  426.8±40.0 °C(Predicted)
• 密度：
  1.053±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  28.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-甲基-6-氯吡啶 在 lithium diisopropyl amide 作用下， 以 正丁醇 为溶剂， 反应 69.0h， 生成 1-[6-(Cyclohexylmethyl)pyridin-2-yl]piperazine
  参考文献：
  名称：

  6-Alkyl-N,N-disubstituted-2-pyridinamines as anticonvulsant agents

  摘要：

  The anticonvulsant effect of a series of 6-alkyl-N,N-disubstituted-2-pyridinamines is described. An investigation was carried out to optimize the anticonvulsant activity and reduce behavioral side effects in this series. Three compounds (7, 8, 10; Table I) were selected from initial screening for a more complete pharmacological evaluation. While each of these compounds was a potent anticonvulsant agent with ED50 values from 5 to 10 mg/kg, the activity was accompanied by significant behavioral side effects including decreased spontaneous locomotion, ataxia, and ptosis.

  DOI：

  10.1021/jm00126a015

文献信息

• Novel compounds and their use
  申请人：——

  公开号：US20020147200A1

  公开（公告）日：2002-10-10

  A compound of the general formula (I): 1 wherein R 1 , R 2 , X, Y and Z are as described in the specification.

  通式（I）的化合物：其中R1、R2、X、Y和Z如规范中所述。
• PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR
  申请人：BIOVITRUM AB

  公开号：EP1335907A1

  公开（公告）日：2003-08-20
• NOVEL COMPOUNDS AND THEIR USE
  申请人：Biovitrum AB

  公开号：EP1506185A1

  公开（公告）日：2005-02-16
• COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT
  申请人：BIOVITRUM AB

  公开号：EP1506185B1

  公开（公告）日：2006-05-24
• US6593330B2
  申请人：——

  公开号：US6593330B2

  公开（公告）日：2003-07-15