N-benzyl-3-imidazol-1-ylpropanamide | 930488-33-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: N-benzyl-3-imidazol-1-ylpropanamide
• CAS: 930488-33-8
• 化学式: C₁₃H₁₅N₃O
• 分子量: 229.282
• InChiKey: FKSYIDUQDYXPLM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  17
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  46.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1,3-Di(imidazol-1-yl)propan-1-one 、 苄胺 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 以94%的产率得到N-benzyl-3-imidazol-1-ylpropanamide
  参考文献：
  名称：

  One-pot synthesis of β-imidazolylpropionamides

  摘要：

  New efficient one-pot methodology for the preparative synthesis of beta-imidazolylpropionamides was elaborated. It is based on the addition of imidazole to the activated double bond of the intermediate acrylimidazolide in the reaction between diverse acrylic acids and different amines promoted by CDI. A set of structurally and functionally diverse beta-imidazolylpropionamides was obtained in high preparative yields. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.04.096

文献信息

• ISOXAZOLE DERIVATIVES AND USE THEREOF
  申请人：SK Biopharmaceuticals Co., Ltd.

  公开号：EP1971600B1

  公开（公告）日：2013-08-21
• One-pot synthesis of β-imidazolylpropionamides
  作者：Sergey V. Ryabukhin、Dmitry S. Granat、Pavel V. Khodakovskiy、Alexander N. Shivanyuk、Andrey A. Tolmachev

  DOI：10.1016/j.tetlet.2008.04.096

  日期：2008.6

  New efficient one-pot methodology for the preparative synthesis of beta-imidazolylpropionamides was elaborated. It is based on the addition of imidazole to the activated double bond of the intermediate acrylimidazolide in the reaction between diverse acrylic acids and different amines promoted by CDI. A set of structurally and functionally diverse beta-imidazolylpropionamides was obtained in high preparative yields. (C) 2008 Elsevier Ltd. All rights reserved.