HCID9947750

1-(4-Trifluoromethylphenyl)-2-methyl-3-pyrrolidino-1-propanone

2-methyl-3-pyrrolidin-1-yl-1-[4-(trifluoromethyl)phenyl]propan-1-one

C15H18F3NO285.3 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(CN1CCCC1)C(=O)c1ccc(C(F)(F)F)cc1
InChIKey: RYZCWZZJFAKYHX-UHFFFAOYSA-N
分子式: C15H18F3NO
平均分子量: 285.3 g/mol
单同位素质量: 285.13404868

COMPUTED

结构计算性质

已同步

XLogP: 3.5
极性表面积: 20.3 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 4
重原子: 20
形式电荷: 0
复杂度: 329

ALIASES

名称与别名

共 6 条

1-(4-trifluoromethylphenyl)-2-methyl-3-pyrrolidino-1-propanoneSCHEMBL5819917CHEBI:1763402-methyl-3-(pyrrolidin-1-yl)-1-[4-(trifluoromethyl)phenyl]propan-1-oneBCB04_0002221-(4-trifluoromethylphenyl)-2-methyl-3-pyrrolidino-1propanone

REACTIONS

参与反应

2 条

uspto-grants-1991_10 · 10.6084/m9.figshare.5104873.v1 · US05057535

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uspto-grants-1992_04 · 10.6084/m9.figshare.5104873.v1 · US05103022

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