Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
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结构与身份
- 标准SMILES
- CC(C)(C)OC(=O)NC1CCN(C(=O)N2CCCCC2)CC1
- InChIKey
- QHTZMHUKWCUEJU-UHFFFAOYSA-N
- 分子式
- C16H29N3O3
- 平均分子量
- 311.42 g/mol
- 单同位素质量
- 311.2208918
COMPUTED
结构计算性质
- XLogP
- 1.8
- 极性表面积
- 61.9 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 3
- 重原子
- 22
- 形式电荷
- 0
- 复杂度
- 392
ALIASES
名称与别名
651056-70-1tert-Butyl 1-(piperidine-1-carbonyl)piperidin-4-ylcarbamatetert-Butyl (1-(piperidine-1-carbonyl)piperidin-4-yl)carbamatetert-butyl N-[1-(piperidine-1-carbonyl)piperidin-4-yl]carbamateMFCD18377963tert-butyl [1-(piperidine-1-carbonyl)piperidin-4-yl]carbamateSCHEMBL14417799QHTZMHUKWCUEJU-UHFFFAOYSA-NAKOS027386061KS-6297F064159tert-butyl [1-(piperidin-1-ylcarbonyl)piperidin-4-yl]carbamatetert-butyl N-[1-(piperidine-1-carbonyl)-4-piperidyl]carbamatetert-Butyl(1-(piperidine-1-carbonyl)piperidin-4-yl)carbamate
REACTIONS
参与反应
uspto-grants-2007_09 · 10.6084/m9.figshare.5104873.v1 · US07268150B2
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