CAS 15883-20-2|CAS 27262-40-4|N-(2,6-dimethylphenyl)piperidine-2-carboxamide|N-(2,6-dimethylphenyl)piperidine-2-carboxamide|N-(2,6-Dimethylphenyl)piperidine-2-carboxamide|2-[(Piperidin-2-ylcarbonyl)...

基本信息

化学结构

分子式

C₁₄H₂₀N₂O

分子量

232.3214

精确质量

232.15756327

电荷

InChI

InChI=1S/C14H20N2O/c1-10-6-5-7-11(2)13(10)16-14(17)12-8-3-4-9-15-12/h5-7,12,15H,3-4,8-9H2,1-2H3,(H,16,17)

InChIKey

SILRCGDPZGQJOQ-UHFFFAOYSA-N

Canonic Smiles

O=C(C1CCCCN1)Nc1c(C)cccc1C

Isomeric Smiles

N1C(CCCC1)C(=O)Nc1c(cccc1C)C

计算属性

JChem

Acid pKa

13.6328125

质子受体

质子供体

LogD (pH = 5.5)

-0.038040735

LogD (pH = 7.4)

1.6142436

Log P

2.8085718

摩尔折射率

71.025

极化性

26.906809

极化表面积

41.13

可自由旋转的化学键

里宾斯基五规则

true

数据来源

名称和标识

IUPAC传统名

N-(2,6-dimethylphenyl)piperidine-2-carboxamide

IUPAC标准名

N-(2,6-dimethylphenyl)piperidine-2-carboxamide

别名

N-(2,6-Dimethylphenyl)piperidine-2-carboxamide2-[(Piperidin-2-ylcarbonyl)amino]-m-xylene2-[(2,6-Dimethylphenyl)carbamoyl]piperidineDesbutylbupivacaineDebutylbupivacaine(2S)-N-(2,6-dimethylphenyl)-2-PiperidinecarboxamideN-Desbutyl (S)-BupivacaineN-Desmethyl (S)-MepivacaineL-Pipecolic Acid 2,6-XylidideN-(2,6-Dimethylphenyl)-2-piperidinecarboxamideN-Desbutyl Bupivacaine2’,6’-PipecoloxylidideN-Desmethyl Mepivacaine2’,6’-PipecolylxylidineBupivacaine Imp. B (EP)(S)-N-(2,6-dimethylphenyl)-2-Piperidinecarboxamide(+)-2',6'-PipecoloxylidideN-Despropyl RopivacaineN-(2',6'-Dimethylphenyl)-2-piperidinecarboxamide

名称和标识

数据登录号

PubChem SID

PubChem CID

CAS号

MDL号

数据登录号

化合物性质