기본 정보
- 표준 SMILES
C[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1C(=O)OCc1ccccc1- InChIKey
GRCXWFCHLUQNEW-GOEBONIOSA-N- 분자식
- C19H28N2O4
- 평균 분자량
- 348.4 g/mol
이름 및 식별자
- 우선 이름
- benzyl (2S,5R)-5-((tert-butoxycarbonyl)amino)-2-methylpiperidine-1-carboxylate
- IUPAC
- benzyl (2S,5R)-2-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-1-carboxylate
이름 및 동의어
1207853-22-2benzyl (2S,5R)-5-((tert-butoxycarbonyl)amino)-2-methylpiperidine-1-carboxylateSCHEMBL376614GRCXWFCHLUQNEW-GOEBONIOSA-NMFCD31803563SY350878(3R,6R)-N-Boc-1-Cbz-6-methylpiperidin-3-aminebenzyl (2S,5R)-2-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-1-carboxylatebenzyl(2S,5R)-5-((tert-butoxycarbonyl)amino)-2-methylpiperidine-1-carboxylateCis-phenylmethyl-5-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-methyl-1-piperidinecarboxylatePhenylmethyl (2S,5R)-5-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-methyl-1-piperidinecarboxylatePhenylmethyl(2S,5R)-5-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-methyl-1-piperidinecarboxylate
데이터베이스 식별자
- PubChem CID
- 51354040
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 67.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 455
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관련 반응
2건
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