2-acetyl-3-(1H-indol-3-yl)-N,N-dimethyl-4-nitrobutanamide | 1370438-11-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 2-acetyl-3-(1H-indol-3-yl)-N,N-dimethyl-4-nitrobutanamide
• CAS: 1370438-11-1
• 化学式: C₁₆H₁₉N₃O₄
• 分子量: 317.345
• InChiKey: RFORYRZYYJEPMQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  99
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N,N-二甲基乙酰基乙酰胺 、 3-(2-硝基乙烯基)吲哚 在 potassium carbonate 作用下， 反应 0.75h， 以91%的产率得到2-acetyl-3-(1H-indol-3-yl)-N,N-dimethyl-4-nitrobutanamide
  参考文献：
  名称：

  Solvent-Free Michael Addition to Non-protected 3-(2-Nitrovinyl)indole by Ultrasound Activation

  摘要：

  A variety of nucleophiles provided by activated methylenes have been added on 3-(2-nitrovinyl)-1H-indole in very good to excellent yields, under sonication and solvent-free conditions, using solid potassium carbonate or sodium acetate as a base. Direct synthesis avoiding preliminary NH protection is reported and exemplified to 15 molecules.

  DOI：

  10.1021/jo2026096

文献信息

• Solvent-Free Michael Addition to Non-protected 3-(2-Nitrovinyl)indole by Ultrasound Activation
  作者：Marc Baron、Estelle Métay、Marc Lemaire、Florence Popowycz

  DOI：10.1021/jo2026096

  日期：2012.4.6

  A variety of nucleophiles provided by activated methylenes have been added on 3-(2-nitrovinyl)-1H-indole in very good to excellent yields, under sonication and solvent-free conditions, using solid potassium carbonate or sodium acetate as a base. Direct synthesis avoiding preliminary NH protection is reported and exemplified to 15 molecules.