N'-(4-Chloro-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-3-yl)-N,N-dimethyl-formamidine | 186089-60-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N'-(4-Chloro-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-3-yl)-N,N-dimethyl-formamidine
• CAS: 186089-60-1
• 化学式: C₁₃H₁₈ClN₃
• 分子量: 251.759
• InChiKey: GGYSDSZPCPSFAH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.23
• 重原子数：
  17.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  28.49
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  N'-(4-Chloro-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-3-yl)-N,N-dimethyl-formamidine 在 硫酸 作用下， 反应 1.5h， 以84%的产率得到4-Chloro-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-3-ylamine
  参考文献：
  名称：

  Intermolecular transfer of an alkenyl group in enamines: Application to synthesis of [b]-fused pyridines

  摘要：

  A novel intermolecular alkenyl transfer of enamines was developed for the preparation of cycloalkenylaminomethyleneoxazolones, which were thermally cyclized to [b]-fused pyridines in good yields. The functional manipulation of the pyridines provided versatile precursors for further annulation to tricyclic ring systems. Copyright (C) 1996 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(96)02071-0
• 作为产物：
  描述：

  N-(4-Oxo-4,5,6,7,8,9-hexahydro-1H-cyclohepta[b]pyridin-3-yl)-benzamide 在 三氯氧磷 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 15.0h， 以82%的产率得到N'-(4-Chloro-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-3-yl)-N,N-dimethyl-formamidine
  参考文献：
  名称：

  Intermolecular transfer of an alkenyl group in enamines: Application to synthesis of [b]-fused pyridines

  摘要：

  A novel intermolecular alkenyl transfer of enamines was developed for the preparation of cycloalkenylaminomethyleneoxazolones, which were thermally cyclized to [b]-fused pyridines in good yields. The functional manipulation of the pyridines provided versatile precursors for further annulation to tricyclic ring systems. Copyright (C) 1996 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(96)02071-0