1-Boc-4-(2-二甲基氨基乙基氨基)哌啶 | 887588-43-4
1-Boc-4-(2-二甲基氨基乙基氨基)哌啶
tert-butyl 4-{[2-(dimethylamino)ethyl]amino}piperidine-1-carboxylate
887588-43-4
C14H29N3O2
271.39896
名称和标识符
MDL |
MFCD06656635 |
InChIKey |
UGCKCQWVNFAHKT-UHFFFAOYSA-N |
Inchi |
InChI=1S/C14H29N3O2/c1-14(2,3)19-13(18)17-9-6-12(7-10-17)15-8-11-16(4)5/h12,15H,6-11H2,1-5H3 |
SMILES |
CC(C)(C)OC(=O)N1CCC(CC1)NCCN(C)C |
别名信息
- 英文别名 -
- tert-Butyl 4-((2-(dimethylamino)ethyl)amino)piperidine-1-carboxylate
- 1-Boc-4-(2-Dimethylaminoethylamino)piperidine
- tert-butyl 4-{[2-(dimethylamino)ethyl]amino}piperidine-1-carboxylate
- AB6644
- AB6644
- 887588-43-4
- 887588-43-4
- MFCD06656635
- MFCD06656635
- DTXSID10656254
- DTXSID10656254
- SCHEMBL4622761
- SCHEMBL4622761
- UGCKCQWVNFAHKT-UHFFFAOYSA-N
- UGCKCQWVNFAHKT-UHFFFAOYSA-N
- tert-Butyl 4-(2-(dimethylamino) ethylamino)piperidine-1-carboxylate
- tert-Butyl 4-(2-(dimethylamino) ethylamino)piperidine-1-carboxylate
- tert-butyl 4-[2-(dimethylamino)ethylamino]piperidine-1-carboxylate
- tert-butyl 4-[2-(dimethylamino)ethylamino]piperidine-1-carboxylate
- tert-Butyl4-((2-(dimethylamino)ethyl)amino)piperidine-1-carboxylate
- tert-Butyl4-((2-(dimethylamino)ethyl)amino)piperidine-1-carboxylate
- FT-0739116
- FT-0739116
- CS-0330556
- CS-0330556
- 4-(2-Dimethylaminoethylamino)piperidine-1-carboxylic acid tert-butyl ester
- 4-(2-Dimethylaminoethylamino)piperidine-1-carboxylic acid tert-butyl ester
物化性质
计算特性
精确分子量 |
271.22597718g/mol |
氢键供体数量 |
1 |
氢键受体数量 |
5 |
可旋转化学键数量 |
7 |
同位素质量 |
271.22597718g/mol |
重原子数量 |
19 |
复杂度 |
279 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
1.3 |
拓扑分子极性表面积 |
44.8Ų |