1-(3-(piperidin-1-yl)propyl)azepan-2-one | 1425053-06-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 内酰胺类
• 英文名称: 1-(3-(piperidin-1-yl)propyl)azepan-2-one
• 英文别名: 1-(3-Piperidin-1-ylpropyl)azepan-2-one；1-(3-piperidin-1-ylpropyl)azepan-2-one
• CAS: 1425053-06-0
• 化学式: C₁₄H₂₆N₂O
• 分子量: 238.373
• InChiKey: RLKYOBVBGLPFIP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  23.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  哌啶 、 N-乙烯基己内酰胺 、 一氧化碳 在 十二羰基三钌 、 2-(dicyclohexylphosphanyl)-1-(2-methoxyphenyl)-1H-imidazole 、 氢气 作用下， 以 甲醇 、 甲苯 为溶剂， 130.0 ℃ 、6.0 MPa 条件下， 反应 20.0h， 生成 、 1-(3-(piperidin-1-yl)propyl)azepan-2-one
  参考文献：
  名称：

  Efficient and Regioselective Ruthenium-catalyzed Hydro-aminomethylation of Olefins

  摘要：

  An efficient and regioselective ruthenium-catalyzed hydroaminomethlyation of olefins is reported. Key to success is the use of specific 2-phosphino-substituted imidazole ligands and triruthenium dodecacarbonyl as catalyst. Both industrially important aliphatic as well as various functionalized olefins react with primary and secondary amines to give the corresponding secondary and tertiary amines generally in high yields (up to 96%) and excellent regioselectivities (n/iso up to 99:1).

  DOI：

  10.1021/ja312271c

文献信息

• Efficient and Regioselective Ruthenium-catalyzed Hydro-aminomethylation of Olefins
  作者：Lipeng Wu、Ivana Fleischer、Ralf Jackstell、Matthias Beller

  DOI：10.1021/ja312271c

  日期：2013.3.13

  An efficient and regioselective ruthenium-catalyzed hydroaminomethlyation of olefins is reported. Key to success is the use of specific 2-phosphino-substituted imidazole ligands and triruthenium dodecacarbonyl as catalyst. Both industrially important aliphatic as well as various functionalized olefins react with primary and secondary amines to give the corresponding secondary and tertiary amines generally in high yields (up to 96%) and excellent regioselectivities (n/iso up to 99:1).