uspto-grants-2011_01 · 10.6084/m9.figshare.5104873.v1 · US07872139B2
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IDENTITY
结构与身份
- 标准SMILES
- C1CCC(NC2CCCC2)CC1
- InChIKey
- HTPYKHDZMIJYOU-UHFFFAOYSA-N
- 分子式
- C11H21N
- 平均分子量
- 167.29 g/mol
- 单同位素质量
- 167.16739967
COMPUTED
结构计算性质
- XLogP
- 2.9
- 极性表面积
- 12 Ų
- 氢键供体
- 1
- 氢键受体
- 1
- 可旋转键
- 2
- 重原子
- 12
- 形式电荷
- 0
- 复杂度
- 121
ALIASES
名称与别名
n-cyclopentylcyclohexanamine40649-25-0cyclohexyl-cyclopentyl-amineNSC1504starbld0017140SCHEMBL999297SCHEMBL1827996SCHEMBL2917831N-cyclohexyl-N-cyclopentyl amineN-cyclopentyl-N-cyclohexyl amineSCHEMBL25397796HTPYKHDZMIJYOU-UHFFFAOYSA-NNSC-1504AKOS000227163N-(CYCLOPENTEN-L-YL)CYCLOHEXYLAMINEDB-214239CS-0452203EN300-168955
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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