HCID21097530

N-[4-(aminomethyl)-2-methylphenyl]methane-sulfonamide

N-[4-(aminomethyl)-2-methylphenyl]methanesulfonamide

C9H14N2O2S214.29 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: Cc1cc(CN)ccc1NS(C)(=O)=O
InChIKey: KVMGACLGAPIBKN-UHFFFAOYSA-N
分子式: C9H14N2O2S
平均分子量: 214.29 g/mol
单同位素质量: 214.07759887

COMPUTED

结构计算性质

等待补全

XLogP: 0.1
极性表面积: 80.6 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 3
重原子: 14
形式电荷: 0
复杂度: 271

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 2 条

SCHEMBL1660192N-[4-(aminomethyl)-2-methylphenyl]methane-sulfonamide

REACTIONS

相关反应

18 条

HRID 95496 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

HRID 99549 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

HRID 111672 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

HRID 117765 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

HRID 145443 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

HRID 203068 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

HRID 699570 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

HRID 802451 反应方程式

Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D