Ethyl-(4-pyridin-4-yl-butyl)-amine | 189938-87-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: Ethyl-(4-pyridin-4-yl-butyl)-amine
• 英文别名: N-ethyl-4-pyridin-4-ylbutan-1-amine
• CAS: 189938-87-2
• 化学式: C₁₁H₁₈N₂
• 分子量: 178.277
• InChiKey: QVHHWFGCRWMRNH-UHFFFAOYSA-N

物化性质

• 沸点：
  292.9±23.0 °C(Predicted)
• 密度：
  0.936±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  13
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  24.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  Ethyl-(4-pyridin-4-yl-butyl)-amine 在 platinum(IV) oxide 盐酸 、 sodium hydroxide 、 碘代三甲硅烷 、 氢气 、 potassium carbonate 作用下， 以 甲醇 、 氯仿 、 乙腈 为溶剂， 反应 5.5h， 生成 11-[2-[4-[4-(ethylamino)butyl]piperidin-1-yl]acetyl]-5H-benzo[b][1,4]benzodiazepin-6-one
  参考文献：
  名称：

  Synthesis and evaluation of halogenated dibenzodiazepines as muscarinic receptor ligands

  摘要：

  Syntheses of four novel amide analogues of the muscarinic M-2 receptor antagonists, DIBA and BIBN 140, are described from a common intermediate. Pharmacological evaluation through in vitro assays reveals high muscarinic receptor affinity in each of the compounds, but variable subtype selectivity, primarily M-2 but in one case M-3. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00109-1
• 作为产物：
  描述：

  N-(4-Pyridin-4-yl-butyl)-acetamide 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 反应 2.0h， 以80%的产率得到Ethyl-(4-pyridin-4-yl-butyl)-amine
  参考文献：
  名称：

  Synthesis and evaluation of halogenated dibenzodiazepines as muscarinic receptor ligands

  摘要：

  Syntheses of four novel amide analogues of the muscarinic M-2 receptor antagonists, DIBA and BIBN 140, are described from a common intermediate. Pharmacological evaluation through in vitro assays reveals high muscarinic receptor affinity in each of the compounds, but variable subtype selectivity, primarily M-2 but in one case M-3. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00109-1

文献信息

• Synthesis and evaluation of halogenated dibenzodiazepines as muscarinic receptor ligands
  作者：Michael Kassiou、Roger W. Read、Xue-qin Shi

  DOI：10.1016/s0960-894x(97)00109-1

  日期：1997.1

  Syntheses of four novel amide analogues of the muscarinic M-2 receptor antagonists, DIBA and BIBN 140, are described from a common intermediate. Pharmacological evaluation through in vitro assays reveals high muscarinic receptor affinity in each of the compounds, but variable subtype selectivity, primarily M-2 but in one case M-3. (C) 1997 Elsevier Science Ltd.