3-(3-吗啡啉丙胺)丙氰 | 102440-39-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 中文名称: 3-(3-吗啡啉丙胺)丙氰
• 中文别名: 3-[(3-吗啉丙基)氨基]丙腈
• 英文名称: N-(3-morpholin-4-yl-propyl)-β-alanine nitrile
• 英文别名: N-(3-morpholino-propyl)-β-alanine-nitrile；N-(3-Morpholino-propyl)-β-alanin-nitril；N-(β-Cyan-ethyl)-3-morpholino-propylamin；(2-Cyan-ethyl)-(3-morpholinopropyl)amin；3-(3-Morpholinopropylamino)propanenitrile；3-(3-morpholin-4-ylpropylamino)propanenitrile
• CAS: 102440-39-1
• 化学式: C₁₀H₁₉N₃O
• mdl: MFCD01566865
• 分子量: 197.28
• InChiKey: DLHVNVSLZVDSRJ-UHFFFAOYSA-N

物化性质

• 沸点：
  180 °C
• 密度：
  1.015±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.5
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.9
• 拓扑面积：
  48.3
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 危险品标志：
  Xi
• 海关编码：
  2934999090

反应信息

• 作为反应物：
  描述：

  3-(3-吗啡啉丙胺)丙氰 在 镍 氨 、 氢气 、 sodium methylate 、 sodium hydride 作用下， 以 甲醇 、 三乙胺 、 苯 为溶剂， 生成 1-ethyl-3-(3-morpholin-4-ylpropyl)-1,3-diazinan-2-one
  参考文献：
  名称：

  Design, synthesis and biological evaluation of 1,3-diaminopropanes: a new class of polyamine analogs as leishmanicidal agents

  摘要：

  Analogs of I,S-diaminopropane as inhibitors for the growth of Leishmania donovani have been synthesized and evaluated,for their antileishmanial activity. Of the many active compounds, 1-(3-N,N-bis methoxycarbonyl guanidino)propyl-4-methylpiperidine piperazine (4e,f) exhibited significant in vivo inhibitory efficacy against L. donovani by oral and intraperitoneal route of administration. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00087-5
• 作为产物：
  描述：

  3-(4-吗啉基)丙腈 在 氨 作用下， 105.0 ℃ 、27.46 MPa 条件下， 生成 3-(3-吗啡啉丙胺)丙氰
  参考文献：
  名称：

  Basically Substituted Aliphatic Nitriles and their Catalytic Reduction to Amines¹

  摘要：

  DOI：

  10.1021/ja01233a019

文献信息

• Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor
  申请人：——

  公开号：US20030225097A1

  公开（公告）日：2003-12-04

  Compounds of formula (I): 1 wherein: X is a group of formula (A) or (B): 2 and R 1 , R 2 , R 3 , R 4 , n, x, y and z are as defined within are described. Processes for their preparation and their use in the treatment of disorders mediated by the neuropeptide Y5 receptor in a warm-blooded animal, such as a human being are also described.

  式(I)的化合物： 其中： X是式(A)或(B)的基团： 而R1、R2、R3、R4、n、x、y和z的定义如所述。 还描述了它们的制备过程以及它们在治疗由神经肽Y5受体介导的疾病中的用途，如在温血动物，如人类中的用途。
• Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by NP Y5 receptor
  申请人：Block Howard Michael

  公开号：US20050209233A1

  公开（公告）日：2005-09-22

  Compounds of formula (I): wherein: X is a group of formula (B): and R 1 , R 2 , R 4 , n, x, y and z are as defined within are described. Processes for their preparation and their use in the treatment of disorders mediated by the neuropeptide Y5 receptor in a warm-blooded animal, such as a human being, are also described.

  本文描述了化学式（I）的化合物：其中X是化学式（B）的基团，并且R1、R2、R4、n、x、y和z的定义如所述。还描述了它们的制备过程以及它们在治疗温血动物（如人类）中由神经肽Y5受体介导的疾病中的应用。
• Basically Substituted Aliphatic Nitriles and their Catalytic Reduction to Amines¹
  作者：Frank C. Whitmore、Harry S. Mosher、Robert R. Adams、Robert B. Taylor、Earl C. Chapin、Charles Weisel、William Yanko

  DOI：10.1021/ja01233a019

  日期：1944.5
• AMINO SUBSTITUTED DIBENZOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY THE NP Y5 RECEPTOR
  申请人：AstraZeneca AB

  公开号：EP1278739A1

  公开（公告）日：2003-01-29
• US6967216B2
  申请人：——

  公开号：US6967216B2

  公开（公告）日：2005-11-22