HCID12501433

2,3,4,4a,9,9a-hexahydro-1H-indeno[2,1-b]pyridine

C12H15N173.25 g/mol

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IDENTITY

结构与身份

标准SMILES: c1ccc2c(c1)CC1NCCCC21
InChIKey: OOERPQACTFFTHC-UHFFFAOYSA-N
分子式: C12H15N
平均分子量: 173.25 g/mol
单同位素质量: 173.12044948

COMPUTED

结构计算性质

已同步

XLogP: 2.1
极性表面积: 12 Å²
氢键供体: 1
氢键受体: 1
可旋转键: 0
重原子: 13
形式电荷: 0
复杂度: 190

ALIASES

名称与别名

共 2 条

SCHEMBL1206327SCHEMBL1207538

REACTIONS

参与反应

32 条

HRID 86608 反应方程式

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

HRID 91209 反应方程式

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

HRID 91933 反应方程式

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

HRID 98746 反应方程式

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

HRID 109908 反应方程式

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

HRID 170427 反应方程式

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

HRID 196361 反应方程式

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

HRID 206468 反应方程式

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