(S)-N-(diphenylmethyl)-N-[1-(5-oxazolyl)ethyl]-2-propenamide | 1322628-86-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (S)-N-(diphenylmethyl)-N-[1-(5-oxazolyl)ethyl]-2-propenamide
• 英文别名: N-benzhydryl-N-[(1S)-1-(1,3-oxazol-5-yl)ethyl]prop-2-enamide
• CAS: 1322628-86-3
• 化学式: C₂₁H₂₀N₂O₂
• 分子量: 332.402
• InChiKey: MBWYIHUURNCOIV-INIZCTEOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  25
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  46.3
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (S)-N-(diphenylmethyl)-N-[1-(5-oxazolyl)ethyl]-2-propenamide 以 邻二氯苯 为溶剂， 反应 1.5h， 以25%的产率得到(S)-2-(diphenylmethyl)-2,3-dihydro-3-methyl-1H-pyrrolo[3,4-c]pyridin-1-one
  参考文献：
  名称：

  Formation of the 1H-Pyrrolo[3,4-c]pyridin-1-one Skeleton via Intramolecular Diels-Alder Reaction of Oxazoles

  摘要：

  The 1H-pyrrolo[3,4-c]pyridin-1-one derivatives (4a-c) were prepared through a route employing the intramolecular Die Is Alder reaction of the oxazole-olefins (3a-c). Conversion of the crotonamide (3a) into 4a was effectively promoted by the addition of Cu(OTf)(2) as a catalyst.

  DOI：

  10.3987/com-11-12197
• 作为产物：
  描述：

  benzophenoneimine 在 4-二甲氨基吡啶 、 sodium cyanoborohydride 、 溶剂黄146 、 三乙胺 作用下， 以 甲醇 、 二氯甲烷 、 苯 为溶剂， 反应 30.5h， 生成 (S)-N-(diphenylmethyl)-N-[1-(5-oxazolyl)ethyl]-2-propenamide
  参考文献：
  名称：

  Formation of the 1H-Pyrrolo[3,4-c]pyridin-1-one Skeleton via Intramolecular Diels-Alder Reaction of Oxazoles

  摘要：

  The 1H-pyrrolo[3,4-c]pyridin-1-one derivatives (4a-c) were prepared through a route employing the intramolecular Die Is Alder reaction of the oxazole-olefins (3a-c). Conversion of the crotonamide (3a) into 4a was effectively promoted by the addition of Cu(OTf)(2) as a catalyst.

  DOI：

  10.3987/com-11-12197

文献信息

• Formation of the 1H-Pyrrolo[3,4-c]pyridin-1-one Skeleton via Intramolecular Diels-Alder Reaction of Oxazoles
  作者：Masashi Ohba、Kei Fukuyama、Yuko Izumi、Masaki Inaki

  DOI：10.3987/com-11-12197

  日期：——

  The 1H-pyrrolo[3,4-c]pyridin-1-one derivatives (4a-c) were prepared through a route employing the intramolecular Die Is Alder reaction of the oxazole-olefins (3a-c). Conversion of the crotonamide (3a) into 4a was effectively promoted by the addition of Cu(OTf)(2) as a catalyst.