기본 정보
- 표준 SMILES
Cc1cc([C@H](C)N)ncc1-c1ccnc(C(F)(F)F)c1- InChIKey
VVAIOLLXNSNFIJ-VIFPVBQESA-N- 분자식
- C14H14F3N3
- 평균 분자량
- 281.28 g/mol
이름 및 식별자
- 우선 이름
- (S)-1-(4-Methyl-2'-(trifluoromethyl)-[3,4'-bipyridin]-6-yl)ethan-1-amine
- IUPAC
- (1S)-1-[4-methyl-5-[2-(trifluoromethyl)-4-pyridinyl]-2-pyridinyl]ethanamine
이름 및 동의어
1628106-86-4(S)-1-(4-Methyl-2'-(trifluoromethyl)-[3,4'-bipyridin]-6-yl)ethan-1-amine(1S)-1-[4-methyl-5-[2-(trifluoromethyl)-4-pyridyl]-2-pyridyl]ethanamineMFCD29075974(1S)-1-[4-Methyl-2'-(trifluoromethyl)-[3,4'-bipyridin]-6-yl]ethan-1-amine(1S)-1-[4-methyl-5-[2-(trifluoromethyl)pyridin-4-yl]pyridin-2-yl]ethanamine[3,4'-Bipyridine]-6-methanamine, alpha,4-dimethyl-2'-(trifluoromethyl)-, (alphaS)-SCHEMBL16055951AS-80459CS-0101545P19990-(trifluoromethyl)[3,4'-bipyridine]-6-methanamine
이름 더 보기
-(trifluoromethyl)[3,4'-bipyridine]-6-methanamine"(S)-1-(4-methyl-2'-(trifluoromethyl)-[3,4'-bipyridin]-6-yl)ethanamine
데이터베이스 식별자
- PubChem CID
- 90423562
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 51.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 321
관련 반응
2건
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