3,5-Bis(methylamino)pyridine-4-carbonitrile | 211571-71-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 3,5-Bis(methylamino)pyridine-4-carbonitrile
• 英文别名: 3,5-bis(methylamino)pyridine-4-carbonitrile
• CAS: 211571-71-0
• 化学式: C₈H₁₀N₄
• 分子量: 162.194
• InChiKey: FTKWCOXNOPUHNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  60.7
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3,5-Bis(methylamino)pyridine-4-carbonitrile 在 palladium on activated charcoal 氢气 作用下， 以 溶剂黄146 为溶剂， 生成 4-Aminomethyl-N,N'-dimethyl-pyridine-3,5-diamine
  参考文献：
  名称：

  Synthesis of Pluriaminated Pyridines

  摘要：

  The key reagent 3,5-dichloro-4-pyridinecarbonitrile (1) was used to synthesize 4-aminomethylpyridine derivatives 3,5-disubstituted with various amino groups, very active as inhibitors of diamine oxidase. The study of the reaction allowed to discover conditions for the gradual substitution in good yields of the two chlorine atoms to give symmetrically and unsymmetrically disubstituted derivatives (3), or the substitution of the cyano group, or the formation of amidines. The reduction of the cyano to aminomethyl group in compounds (3) afforded the target bioactive products.

  DOI：

  10.3987/com-98-8144
• 作为产物：
  描述：

  3,5-二氯-4-氰基吡啶 以 N,N-二甲基甲酰胺 为溶剂， 生成 3,5-Bis(methylamino)pyridine-4-carbonitrile
  参考文献：
  名称：

  Synthesis of Pluriaminated Pyridines

  摘要：

  The key reagent 3,5-dichloro-4-pyridinecarbonitrile (1) was used to synthesize 4-aminomethylpyridine derivatives 3,5-disubstituted with various amino groups, very active as inhibitors of diamine oxidase. The study of the reaction allowed to discover conditions for the gradual substitution in good yields of the two chlorine atoms to give symmetrically and unsymmetrically disubstituted derivatives (3), or the substitution of the cyano group, or the formation of amidines. The reduction of the cyano to aminomethyl group in compounds (3) afforded the target bioactive products.

  DOI：

  10.3987/com-98-8144

文献信息

• Synthesis of Pluriaminated Pyridines
  作者：Angela De Munno、Vincenzo Bertini、Nevio Picci、Francesca Iemma、Marco Pocci

  DOI：10.3987/com-98-8144

  日期：——

  The key reagent 3,5-dichloro-4-pyridinecarbonitrile (1) was used to synthesize 4-aminomethylpyridine derivatives 3,5-disubstituted with various amino groups, very active as inhibitors of diamine oxidase. The study of the reaction allowed to discover conditions for the gradual substitution in good yields of the two chlorine atoms to give symmetrically and unsymmetrically disubstituted derivatives (3), or the substitution of the cyano group, or the formation of amidines. The reduction of the cyano to aminomethyl group in compounds (3) afforded the target bioactive products.