4-Methylamino-3-methylbutanon-2 | 44642-69-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-Methylamino-3-methylbutanon-2
• 英文别名: 2-Butanone, 3-methyl-4-(methylamino)-；3-methyl-4-(methylamino)butan-2-one
• CAS: 44642-69-5
• 化学式: C₆H₁₃NO
• 分子量: 115.175
• InChiKey: VTURIGBWCJSJHB-UHFFFAOYSA-N

物化性质

• 沸点：
  165.2±23.0 °C(Predicted)
• 密度：
  0.860±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0
• 重原子数：
  8
• 可旋转键数：
  3
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  29.1
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  3-methyl-4-methylamino-but-3-en-2-one 在 红铝 作用下， 以 乙醚 、 苯 为溶剂， 生成 4-Methylamino-3-methylbutanon-2
  参考文献：
  名称：

  Reduction of 3-Aminomethylenebutan-2-ones by Sodium Bis[2-methoxyethoxy]alanate

  摘要：

  DOI：

  10.1055/s-1974-23244

文献信息

• Small Molecule Inhibitors Selective For Polo-Like Kinase Proteins
  申请人：University of South Carolina

  公开号：US20170283445A1

  公开（公告）日：2017-10-05

  Disclosed are small molecule PLK inhibitors that can target the polo box domain (PBD). Inhibitors can have an atomic mass of about 1000 Da or less and a general structure of For instance, the inhibitors can include an alkyl benzamido benzoic acid core structure.

  揭示了可以靶向波洛盒结构域（PBD）的小分子PLK抑制剂。抑制剂的原子质量约为1000 Da或更低，一般结构如下：例如，抑制剂可以包括烷基苯甲酰苯甲酸核心结构。
• Methods for the Synthesis of Dicarba Bridges in Organic Compounds
  申请人：Robinson Andrea Jane

  公开号：US20100036089A1

  公开（公告）日：2010-02-11

  The present invention relates to methods for forming dicarba bridges in organic compounds. This involves the use of a pair of complementary metathesisable groups on the organic compound, and subjecting the compound to cross-metathesis under microwave radiation conditions. In an alternative, the compounds contain a turn-inducing group between the pair of cross-metathesisable groups to facilitate the cross-metathesis.

  本发明涉及有机化合物中形成二碳桥的方法。这涉及在有机化合物上使用一对互补的可交换基团，并在微波辐射条件下使化合物经历交叉重合反应。或者，化合物在一对交叉重合基团之间含有一个转向诱导基团，以促进交叉重合反应。
• Badosov,E.P. et al., Journal of Organic Chemistry USSR (English Translation), 1975, vol. 11, p. 962 - 966
  作者：Badosov,E.P. et al.

  DOI：——

  日期：——
• Boiko,I.P. et al., Journal of Organic Chemistry USSR (English Translation), 1976, vol. 12, # 10, p. 2052 - 2059
  作者：Boiko,I.P. et al.

  DOI：——

  日期：——
• PRODRUGS OF GUANFACINE
  申请人：Franklin Richard

  公开号：US20120178666A1

  公开（公告）日：2012-07-12

  Prodrugs of guanfacine with amino acids or short peptides, pharmaceutical compositions containing such prodrugs and a method for providing therapeutic benefit in the treatment of ADHD/ODD (attention deficient hyperactivity disorder and oppositional defiance disorder) with guanfacine prodrugs are provided herein. Additionally, methods for minimizing or avoiding the adverse gastrointestinal side effects associated with guanfacine administration, as well as improving the pharmacokinetics of guanfacine are provided herein.