기본 정보
- 표준 SMILES
COC(=O)[C@@H]1C[C@H](NCC(C)C)CN(C(=O)OC(C)(C)C)C1- InChIKey
ONUXPROPUGGHJY-OLZOCXBDSA-N- 분자식
- C16H30N2O4
- 평균 분자량
- 314.42 g/mol
- 단동위원소 질량
- 314.22055744
이름 및 식별자
- 우선 이름
- 1-tert-butyl 3-methyl (3R,5S)-5-[(2-methylpropyl)amino]piperidine-1,3-dicarboxylate
- IUPAC
- 1-O-tert-butyl 3-O-methyl (3R,5S)-5-(2-methylpropylamino)piperidine-1,3-dicarboxylate
이름 및 동의어
1145745-30-71-tert-butyl 3-methyl (3R,5S)-5-[(2-methylpropyl)amino]piperidine-1,3-dicarboxylate1-(tert-butyl) 3-methyl (3R,5S)-5-(isobutylamino)piperidine-1,3-dicarboxylate1-tert-butyl 3-methyl (3R,5S)-5-{(2-methylpropyl)amino}piperidine-1,3-dicarboxylate1-tert-butyl 3-methyl(3R,5S)-5-[(2-methylpropyl)amino]piperidine-1,3-dicarboxylate1-tert-butyl 3-methyl(3R,5S)-5-{(2-methylpropyl)amino}piperidine-1,3-dicarboxylateSCHEMBL1421266ONUXPROPUGGHJY-OLZOCXBDSA-N1-tert-butyl 3-methyl (3R*,5S*)-5-(isobutylamino)piperidine-1,3-dicarboxylate1-tert-butyl 3-methyl (3R,5S)-5-(isobutylamino)piperidine-1,3-dicarboxylate1-tert-butyl3-methyl(3R,5S)-5-[(2-methylpropyl)amino]piperidine-1,3-dicarboxylate
데이터베이스 식별자
- PubChem CID
- 59356607
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 67.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 390
관련 반응
31건
화합물 노트
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