cis-(1S,2S)-2-(3-methoxyphenyl)-N,N-dipropylcyclohexylamine | 149250-85-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: cis-(1S,2S)-2-(3-methoxyphenyl)-N,N-dipropylcyclohexylamine
• 英文别名: (1S,2S)-2-(3-methoxyphenyl)-N,N-dipropylcyclohexan-1-amine
• CAS: 149250-85-1
• 化学式: C₁₉H₃₁NO
• 分子量: 289.461
• InChiKey: XDYOEMMJCPQPPC-OALUTQOASA-N

物化性质

• 沸点：
  392.2±42.0 °C(predicted)
• 密度：
  0.97±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  cis-(1S,2S)-2-(3-methoxyphenyl)-N,N-dipropylcyclohexylamine 在 氢溴酸 作用下， 反应 2.0h， 以96%的产率得到cis-(1S,2S)-2-(3-hydroxyphenyl)-N,N-dipropylcyclohexylamine hydrobromide
  参考文献：
  名称：

  Resolved 2-arylcyclohexylamines: Effects on reserpine akinesia and central nervous system monoamine synthesis

  摘要：

  A series of cis- and trans-2-arylcyclohexylamines were synthesized and resolved. The absolute configuration was determined by single-crystal X-ray analysis. Some of the compounds, and especially racemic 2-(3-hydroxyphenyl)-N,N-dipropylcyclohexylamine showed a marked locomotor stimulation in reserpinized rats. However, these compounds displayed only minor effects on dopamine and 5-hydroxytryptamine synthesis rates, indicating a non-dopaminergic and/or serotonergic mechanism for this stimulation.

  DOI：

  10.1016/0223-5234(93)90079-t
• 作为产物：
  描述：

  cis-(1S,2S)-2-(3-methoxyphenyl)-N-propylcyclohexylamine 在 lithium aluminium tetrahydride 、 三乙胺 作用下， 以 乙醚 、 二氯甲烷 为溶剂， 反应 3.5h， 生成 cis-(1S,2S)-2-(3-methoxyphenyl)-N,N-dipropylcyclohexylamine
  参考文献：
  名称：

  Resolved 2-arylcyclohexylamines: Effects on reserpine akinesia and central nervous system monoamine synthesis

  摘要：

  A series of cis- and trans-2-arylcyclohexylamines were synthesized and resolved. The absolute configuration was determined by single-crystal X-ray analysis. Some of the compounds, and especially racemic 2-(3-hydroxyphenyl)-N,N-dipropylcyclohexylamine showed a marked locomotor stimulation in reserpinized rats. However, these compounds displayed only minor effects on dopamine and 5-hydroxytryptamine synthesis rates, indicating a non-dopaminergic and/or serotonergic mechanism for this stimulation.

  DOI：

  10.1016/0223-5234(93)90079-t