(S)-N-(1-pphenyleth-1-yl)-N-(1-prop-2-enyl)-3-oxobutanamide | 186299-50-3

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: (S)-N-(1-pphenyleth-1-yl)-N-(1-prop-2-enyl)-3-oxobutanamide
• 英文别名: 3-oxo-N-[(1S)-1-phenylethyl]-N-prop-2-enylbutanamide
• CAS: 186299-50-3
• 化学式: C₁₅H₁₉NO₂
• 分子量: 245.321
• InChiKey: IARRKEWZCAYTIX-ZDUSSCGKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  37.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (S)-N-(1-pphenyleth-1-yl)-N-(1-prop-2-enyl)-3-oxobutanamide 在 磺酰氯 作用下， 以 氘代氯仿 、 氯仿 为溶剂， 反应 1.0h， 生成 (S)-N-(1-pphenyleth-1-yl)-N-(1-prop-2-enyl)-3-oxo-2-chlorobutanamide
  参考文献：
  名称：

  SYNTHESIS OF ENANTIOPURE PYRROLO[3,4-cPYRAZOLE DERIVATIVES VIA INTRAMOLECULAR CYCLOADDITION OF HOMO-CHIRAL NITRILIMINES

  摘要：

  Intramolecular cycloaddition of homochiral nitrilimines 8 was exploited to obtain enantiopure pyrrolo[3,4-c]pyrazole derivatives 9 and 10 with high overall yields.

  DOI：

  10.1081/scc-100108230
• 作为产物：
  描述：

  2,2,6-三甲基-4H-1,3-二英-4-酮 、 (S)-()-N-烯丙基-α-甲基苄胺 以 甲苯 为溶剂， 以71%的产率得到(S)-N-(1-pphenyleth-1-yl)-N-(1-prop-2-enyl)-3-oxobutanamide
  参考文献：
  名称：

  Cyclisation of (R)- and (S)-N-allyl-N-(1-phenylethyl) methoxycarbonylacetamide mediated by Mn(III): Preparation and structural assignment of 3-aza-2-oxobicyclo[3.1.0]hexanes

  摘要：

  (R)- and (S)-N-allyl-N-(I-phenylethyl)methoxycarbonylacetamide, 5 and 6, underwent oxidative cyclisation mediated by Mn(III), to give easily separable diastereomeric mixtures of 3-aza-2-oxobicyclo[3.1.0]hexanes 8a,b and 9a,b, respectively, whose structures were assigned on the basis of H-1 NMR spectra and then confirmed by X-ray diffraction analysis of the derivatives 11b and 14. Copyright (C) 1996 Elsevier Science Ltd.

  DOI：

  10.1016/s0957-4166(96)00466-1

文献信息

• SYNTHESIS OF ENANTIOPURE PYRROLO[3,4-<i>c</i>PYRAZOLE DERIVATIVES VIA INTRAMOLECULAR CYCLOADDITION OF HOMO-CHIRAL NITRILIMINES
  作者：Gianluigi Broggini、Giorgio Molteni、Tullio Pilati、Gaetano Zecchi

  DOI：10.1081/scc-100108230

  日期：2001.1.1

  Intramolecular cycloaddition of homochiral nitrilimines 8 was exploited to obtain enantiopure pyrrolo[3,4-c]pyrazole derivatives 9 and 10 with high overall yields.
• Cyclisation of (R)- and (S)-N-allyl-N-(1-phenylethyl) methoxycarbonylacetamide mediated by Mn(III): Preparation and structural assignment of 3-aza-2-oxobicyclo[3.1.0]hexanes
  作者：Roberta Galeazzi、Silvano Geremia、Giovanna Mobbili、Mario Orena

  DOI：10.1016/s0957-4166(96)00466-1

  日期：1996.12

  (R)- and (S)-N-allyl-N-(I-phenylethyl)methoxycarbonylacetamide, 5 and 6, underwent oxidative cyclisation mediated by Mn(III), to give easily separable diastereomeric mixtures of 3-aza-2-oxobicyclo[3.1.0]hexanes 8a,b and 9a,b, respectively, whose structures were assigned on the basis of H-1 NMR spectra and then confirmed by X-ray diffraction analysis of the derivatives 11b and 14. Copyright (C) 1996 Elsevier Science Ltd.