3-benzyl-1-(dimethylamino)-2-(2-phenylethyl)-1H-pyrrole | 253202-70-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 3-benzyl-1-(dimethylamino)-2-(2-phenylethyl)-1H-pyrrole
• 英文别名: 3-benzyl-N,N-dimethyl-2-(2-phenylethyl)pyrrol-1-amine
• CAS: 253202-70-9
• 化学式: C₂₁H₂₄N₂
• 分子量: 304.435
• InChiKey: FHNXVFQKIAJQRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  8.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-benzyl-1-(dimethylamino)-2-(2-phenylethyl)-1H-pyrrole 在 氨 、 sodium 作用下， -78.0~20.0 ℃ 、1.1 MPa 条件下， 反应 3.0h， 生成 3-benzyl-2-(2-phenylethyl)-1H-pyrrole
  参考文献：
  名称：

  One-Pot Synthesis of Pyrroles through Carbometalation Reaction of Zincated Hydrazone with Vinylstannane

  摘要：

  [GRAPHICS]A new one-pot synthesis of pyrrole derivatives from ketone hydrazone has been developed by aerobic oxidation of functionalized gem-Zn/Sn dimetallic species, which are prepared by the carbometalation reaction of zincated hydrazone with vinylstannane.

  DOI：

  10.1021/ol990911h
• 作为产物：
  描述：

  三丁基乙烯基锡 、 1,5-diphenyl-3-pentanone N,N-dimethylhydrazone 生成 3-benzyl-1-(dimethylamino)-2-(2-phenylethyl)-1H-pyrrole
  参考文献：
  名称：

  One-Pot Synthesis of Pyrroles through Carbometalation Reaction of Zincated Hydrazone with Vinylstannane

  摘要：

  [GRAPHICS]A new one-pot synthesis of pyrrole derivatives from ketone hydrazone has been developed by aerobic oxidation of functionalized gem-Zn/Sn dimetallic species, which are prepared by the carbometalation reaction of zincated hydrazone with vinylstannane.

  DOI：

  10.1021/ol990911h

文献信息

• One-Pot Synthesis of Pyrroles through Carbometalation Reaction of Zincated Hydrazone with Vinylstannane
  作者：Masaharu Nakamura、Kenji Hara、Go Sakata、Eiichi Nakamura

  DOI：10.1021/ol990911h

  日期：1999.11.1

  [GRAPHICS]A new one-pot synthesis of pyrrole derivatives from ketone hydrazone has been developed by aerobic oxidation of functionalized gem-Zn/Sn dimetallic species, which are prepared by the carbometalation reaction of zincated hydrazone with vinylstannane.