1035351-09-7 (1,1-dimethylethyl (2R)-2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate,(R)-Tert-butyl 2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate)

CAS号:
1035351-09-7
中文名称:
1,1-dimethylethyl (2R)-2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate
英文名称:
(R)-Tert-butyl 2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate
分子式:
C13H24N2O3
分子量:
256.341263771057

1,1-dimethylethyl (2R)-2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate(1035351-09-7)名称与标识符

名称

中文别名:
1,1-二甲基乙基 (2r)-2-(3-羟基氮杂啶-3-基)哌啶-1-羧酸;
英文别名:
1,1-dimethylethyl (2R)-2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate;(S)-2-(3-Hydroxyazetidin-3-yl)piperidine-1-carboxylic acid tert-butyl ester;SB20595;PB37291;(R)-tert-butyl 2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate;TERT-BUTYL (2R)-2-(3-HYDROXYAZETIDIN-3-YL)PIPERIDINE-1-CARBOXYLATE;

标识符

InChIKey:
DBXFIYLGJDPVHA-SNVBAGLBSA-N
Inchi:
1S/C13H24N2O3/c1-12(2,3)18-11(16)15-7-5-4-6-10(15)13(17)8-14-9-13/h10,14,17H,4-9H2,1-3H3/t10-/m1/s1
SMILES:
OC1(CNC1)[C@H]1CCCCN1C(=O)OC(C)(C)C

1,1-dimethylethyl (2R)-2-(3-hydroxyazetidin-3-yl)piperidine-1-carboxylate(1035351-09-7)物化性质

计算特性

  • 氢键供体数量 : 2
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 3
  • 重原子数量 : 18
  • 复杂度 : 321
  • 拓扑分子极性表面积 : 61.8