N-[(1R)-2-hydroxy-1-methylethyl]-2,2-dimethylpropanamide | 1395390-79-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: N-[(1R)-2-hydroxy-1-methylethyl]-2,2-dimethylpropanamide
• 英文别名: N-[(2R)-1-hydroxypropan-2-yl]-2,2-dimethylpropanamide
• CAS: 1395390-79-0
• 化学式: C₈H₁₇NO₂
• 分子量: 159.228
• InChiKey: KEKLAXCZNNPLSJ-ZCFIWIBFSA-N

物化性质

• 沸点：
  311.3±25.0 °C(Predicted)
• 密度：
  0.968±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  11
• 可旋转键数：
  3
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  特戊醛 在 碘苯二乙酸 作用下， 以 乙腈 为溶剂， 生成 N-[(1R)-2-hydroxy-1-methylethyl]-2,2-dimethylpropanamide
  参考文献：
  名称：

  Metal-free oxidative amide formation with N-hydroxysuccinimide and hypervalent iodine reagents

  摘要：

  An oxidative amide formation using N-hydroxysuccinimide and hypervalent iodine reagents was developed. The method enables a wide range of aldehydes and amines to be coupled under mild reaction conditions providing amide in good to excellent yield. The radical species in the reaction mixture was observed for the first time using ESR measurement, and along with other mechanistic investigations, a plausible mechanism of the reaction was proposed. Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2012.07.024

文献信息

• Cyclohexyl Azetidine Derivatives as JAK Inhibitors
  申请人：Rodgers James D.

  公开号：US20130045963A1

  公开（公告）日：2013-02-21

  The present invention provides cyclohexyl azetidine derivatives, as well as their compositions and methods of use, that modulate the activity of Janus kinase (JAK) and are useful in the treatment of diseases related to the activity of JAK including, for example, inflammatory disorders, autoimmune disorders, cancer, and other diseases.

  本发明提供了环己基氮杂丙烷衍生物及其组合物和使用方法，可以调节Janus激酶（JAK）的活性，并且可用于治疗与JAK活性相关的疾病，包括炎症性疾病、自身免疫性疾病、癌症和其他疾病。
• US9359358B2
  申请人：——

  公开号：US9359358B2

  公开（公告）日：2016-06-07
• Metal-free oxidative amide formation with N-hydroxysuccinimide and hypervalent iodine reagents
  作者：Haoyi Yao、Yun Tang、Kana Yamamoto

  DOI：10.1016/j.tetlet.2012.07.024

  日期：2012.9

  An oxidative amide formation using N-hydroxysuccinimide and hypervalent iodine reagents was developed. The method enables a wide range of aldehydes and amines to be coupled under mild reaction conditions providing amide in good to excellent yield. The radical species in the reaction mixture was observed for the first time using ESR measurement, and along with other mechanistic investigations, a plausible mechanism of the reaction was proposed. Published by Elsevier Ltd.