Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- CCC(N)(CC)C(=O)NC
- InChIKey
- XMUOIJNBOSCZEY-UHFFFAOYSA-N
- 分子式
- C7H16N2O
- 平均分子量
- 144.21 g/mol
- 单同位素质量
- 144.12626314
COMPUTED
结构计算性质
- XLogP
- 0.3
- 极性表面积
- 55.1 Ų
- 氢键供体
- 2
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 119
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1415898-90-6SCHEMBL14151901XMUOIJNBOSCZEY-UHFFFAOYSA-N2-Amino-2-ethyl-N-methyl-butyramideAKOS0183687802-Amino-2-ethyl-N-methylbutanamide, 97%
REACTIONS
相关反应
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