(2R)-3-methyl-2-pyrrolidin-1-yl-butan-1-ol | 392234-67-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯烷类
• 英文名称: (2R)-3-methyl-2-pyrrolidin-1-yl-butan-1-ol
• 英文别名: (2R)-3-methyl-2-(pyrrolidin-1-yl)butan-1-ol；(2R)-3-methyl-2-pyrrolidin-1-ylbutan-1-ol
• CAS: 392234-67-2
• 化学式: C₉H₁₉NO
• 分子量: 157.256
• InChiKey: DAXQBFKMRFISCP-VIFPVBQESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  11
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (2R)-3-methyl-2-pyrrolidin-1-yl-butan-1-ol 在 钯 偶氮二甲酸二异丙酯 、 甲酸铵 、 三苯基膦 作用下， 以 四氢呋喃 、 乙醇 、 水 、 乙酸乙酯 为溶剂， 生成 (2S,3R)-2-[4-((R)-3-Methyl-2-pyrrolidin-1-yl-butoxy)-phenyl]-3-(4-triisopropylsilanyloxy-phenyl)-2,3-dihydro-benzo[1,4]oxathiin-6-ol
  参考文献：
  名称：

  Estrogen receptor ligands. Part 9: Dihydrobenzoxathiin SERAMs with alkyl substituted pyrrolidine side chains and linkers

  摘要：

  A series of dihydrobenzoxathiin SERAMs with alkylated pyrrolidine side chains or alkylated linkers was prepared. Minor modifications in the side chain or linker resulted in significant effects on biological activity, especially in uterine tissue.

  DOI：

  10.1016/j.bmcl.2004.10.036
• 作为产物：
  描述：

  1,4-二溴丁烷 、 D-缬氨醇 在 sodium carbonate 作用下， 以 异丙醇 为溶剂， 反应 14.0h， 以81%的产率得到(2R)-3-methyl-2-pyrrolidin-1-yl-butan-1-ol
  参考文献：
  名称：

  A new method for stereoselective oxidation of chiral 2-pyrrolidino-1-ethanol derivatives to oxazolopyrrolidines using trimethylamine-N-oxide in the presence of iron carbonyls

  摘要：

  Chiral 2-pyrrolidino-1-ethanol derivatives were oxidatively cyclized to the corresponding oxazolopyrrolidines, with excellent stereoselectivity by treatment with excess Me3NO in the presence of 20% of an iron carbonyl complex. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.03.101

文献信息

• A new method for stereoselective oxidation of chiral 2-pyrrolidino-1-ethanol derivatives to oxazolopyrrolidines using trimethylamine-N-oxide in the presence of iron carbonyls
  作者：Anthony J. Pearson、Yoonhyun Kwak

  DOI：10.1016/j.tetlet.2005.03.101

  日期：2005.5

  Chiral 2-pyrrolidino-1-ethanol derivatives were oxidatively cyclized to the corresponding oxazolopyrrolidines, with excellent stereoselectivity by treatment with excess Me3NO in the presence of 20% of an iron carbonyl complex. (c) 2005 Elsevier Ltd. All rights reserved.
• Estrogen receptor ligands. Part 9: Dihydrobenzoxathiin SERAMs with alkyl substituted pyrrolidine side chains and linkers
  作者：Timothy A. Blizzard、Frank DiNinno、Jerry D. Morgan、Helen Y. Chen、Jane Y. Wu、Seongkon Kim、Wanda Chan、Elizabeth T. Birzin、Yi Tien Yang、Lee-Yuh Pai、Paula M.D. Fitzgerald、Nandini Sharma、Ying Li、Zhoupeng Zhang、Edward C. Hayes、Carolyn A. DaSilva、Wei Tang、Susan P. Rohrer、James M. Schaeffer、Milton L. Hammond

  DOI：10.1016/j.bmcl.2004.10.036

  日期：2005.1

  A series of dihydrobenzoxathiin SERAMs with alkylated pyrrolidine side chains or alkylated linkers was prepared. Minor modifications in the side chain or linker resulted in significant effects on biological activity, especially in uterine tissue.