uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822702B2
查看IDENTITY
结构与身份
- 标准SMILES
- CN(C)CCc1c[nH]c2ccc(C#N)cc12
- InChIKey
- DSNBRTOYUJFTAH-UHFFFAOYSA-N
- 分子式
- C13H15N3
- 平均分子量
- 213.28 g/mol
- 单同位素质量
- 213.12659749
COMPUTED
结构计算性质
- XLogP
- 1.3
- 极性表面积
- 42.8 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 278
物化、安全与法规信息正在同步。
ALIASES
名称与别名
5-Cyano-N,N-dimethyltryptamine17380-42-6INDOLE-5-CARBONITRILE, 3-(2-DIMETHYLAMINOETHYL)-3-(2-Dimethylamino)ethylindole-5-carbonitrileDTXSID60169667RefChem:349336DTXCID60921583-[2-(dimethylamino)ethyl]-1H-indole-5-carbonitrile3-(2-(Dimethylamino)ethyl)-1H-indole-5-carbonitrileSCHEMBL1122134DSNBRTOYUJFTAH-UHFFFAOYSA-NDA-092983-(2-dimethylamino-ethyl)-1H-indole-5-carbonitrileN,N-dimethyl 2-(5-cyano-1H-indol-3-yl)ethyl-amine
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786156B2
查看uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786156B2
查看uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786156B2
查看uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07951940B2
查看uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07951940B2
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
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