5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3)triazol-1-yl-ethyl)amide

HCID 20761730

기본 정보

표준 SMILES
Cc1[nH]c(C=O)c(C)c1C(=O)NCCn1ccnn1
InChIKey
DVAGMLTYQAJDEP-UHFFFAOYSA-N
분자식
C12H15N5O2
평균 분자량
261.28 g/mol

이름 및 식별자

우선 이름
5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3)triazol-1-yl-ethyl)amide
IUPAC
5-formyl-2,4-dimethyl-N-[2-(triazol-1-yl)ethyl]-1H-pyrrole-3-carboxamide

이름 및 동의어

5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3)triazol-1-yl-ethyl)amide5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3]triazol-1-yl-ethyl)amideDVAGMLTYQAJDEP-UHFFFAOYSA-N5-formyl-2,4-dimethyl-1 H-pyrrole-3-carboxylic acid (2-[1,2,3]triazol-1 -yl-ethyl)-amide5-formyl-2,4-dimethyl-1 H-pyrrole-3-carboxylic acid (2-[1,2,3]triazol-1-yl-ethyl)-amide5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3]-triazol-1-yl-ethyl)-amide5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3]triazol- 1-yl-ethyl)-amide5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (2-[1,2,3]triazol-1-yl-ethyl)-amide

데이터베이스 식별자

PubChem CID
20761730

물성

구조 계산 물성

XLogP
-0.1
극성 표면적
92.7 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
5
무거운 원자 수
19

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