(R)-3-Methyl-5-(1-methylpyrrolidin-2-yl)isoxazole
기본 정보
- CAS
147402-73-1- 표준 SMILES
Cc1cc([C@H]2CCCN2C)on1- InChIKey
ILLGYRJAYAAAEW-MRVPVSSYSA-N- 분자식
- C9H14N2O
- 평균 분자량
- 166.22 g/mol
- 단동위원소 질량
- 166.11061307
이름 및 식별자
- 우선 이름
- (R)-3-Methyl-5-(1-methylpyrrolidin-2-yl)isoxazole
- IUPAC
- 3-methyl-5-[(2R)-1-methylpyrrolidin-2-yl]-1,2-oxazole
- 영어명
- Isoxazole, 3-methyl-5-[(2R)-1-methyl-2-pyrrolidinyl]- (9CI)
- 분자식
- C9H14N2O
- 분자량
- 166.22
이름 및 동의어
147402-73-18OB8II8DDDUNII-8OB8II8DDDABT-418, (R)-(R)-3-Methyl-5-(1-methylpyrrolidin-2-yl)isoxazoleCHEMBL2687503-Methyl-5-(1-methyl-2(R)-pyrrolidinyl)isoxazoleIsoxazole, 3-methyl-5-((2R)-1-methyl-2-pyrrolidinyl)-Isoxazole, 3-methyl-5-(1-methyl-2-pyrrolidinyl)-, (R)-3-Methyl-5-(1-methyl-2(R)-pyrrolidinyl)isoxazole ((R)-isomer)Isoxazole, 3-methyl-5-[(2R)-1-methyl-2-pyrrolidinyl]-(R)-ABT-418
이름 더 보기
3-methyl-5-[(2R)-1-methylpyrrolidin-2-yl]-1,2-oxazoleIsoxazole, 3-methyl-5-[(2R)-1-methyl-2-pyrrolidinyl]- (9CI)A-81754SCHEMBL8114587BDBM50035406DB-2877453-Methyl-5-((R)-1-methyl-pyrrolidin-2-yl)-isoxazole
데이터베이스 식별자
- CAS
147402-73-1- PubChem CID
- 9859069
- ChEMBL
CHEMBL268750- UNII
- 8OB8II8DDD
- Nikkaji
- J588.287G
물성
구조 계산 물성
- XLogP
- 1.2
- 극성 표면적
- 29.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 163
관련 반응
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