(1,4-Dioxa-spiro[4.5]dec-8-ylmethyl)-[2-(1H-indol-3-yl)-ethyl]-amine | 730961-10-1

• 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: (1,4-Dioxa-spiro[4.5]dec-8-ylmethyl)-[2-(1H-indol-3-yl)-ethyl]-amine
• 英文别名: N-(1,4-dioxaspiro[4.5]decan-8-ylmethyl)-2-(1H-indol-3-yl)ethanamine
• CAS: 730961-10-1
• 化学式: C₁₉H₂₆N₂O₂
• 分子量: 314.428
• InChiKey: BSUKGSXGWCUESU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  46.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (1,4-Dioxa-spiro[4.5]dec-8-ylmethyl)-[2-(1H-indol-3-yl)-ethyl]-amine 在 盐酸 、 碘代三甲硅烷 、 三乙胺 作用下， 以 四氢呋喃 、 水 为溶剂， 生成 2,2,2-Trichloro-N-[2-(1H-indol-3-yl)-ethyl]-N-(4-oxo-cyclohex-2-enylmethyl)-acetamide
  参考文献：
  名称：

  Six-membered nitrogen ring formation by radical cyclization of trichloroacetamides with enones. A synthetic entry to cis -perhydroisoquinoline-3,6-diones

  摘要：

  Intramolecular reactions between 1-(carbamoyl)dichloromethyl radicals and enones acting as radical acceptors are reported for the first time. The Bu3SnH promoted 6-exo reaction of trichloroacetamides with enones, avoiding the 1,5-hydrogen transfer, constitutes a new synthetic entry to cis-perhydoisoquinoline-3,6-diones. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.04.104
• 作为产物：
  描述：

  1,4-环己二酮单乙二醇缩酮 、 alkaline earth salt of/the/ methylsulfuric acid 生成 (1,4-Dioxa-spiro[4.5]dec-8-ylmethyl)-[2-(1H-indol-3-yl)-ethyl]-amine
  参考文献：
  名称：

  Six-membered nitrogen ring formation by radical cyclization of trichloroacetamides with enones. A synthetic entry to cis -perhydroisoquinoline-3,6-diones

  摘要：

  Intramolecular reactions between 1-(carbamoyl)dichloromethyl radicals and enones acting as radical acceptors are reported for the first time. The Bu3SnH promoted 6-exo reaction of trichloroacetamides with enones, avoiding the 1,5-hydrogen transfer, constitutes a new synthetic entry to cis-perhydoisoquinoline-3,6-diones. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.04.104