HCID20530715

(4-Fluoro-phenyl)-(4-methyl-piperidin-4-yl)-methanone

(4-fluorophenyl)-(4-methylpiperidin-4-yl)methanone

C13H16FNO221.27 g/mol

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IDENTITY

结构与身份

标准SMILES: CC1(C(=O)c2ccc(F)cc2)CCNCC1
InChIKey: XDFBSWREOVOYSJ-UHFFFAOYSA-N
分子式: C13H16FNO
平均分子量: 221.27 g/mol
单同位素质量: 221.1215923

COMPUTED

结构计算性质

已同步

XLogP: 2.1
极性表面积: 29.1 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 2
重原子: 16
形式电荷: 0
复杂度: 253

ALIASES

名称与别名

共 6 条

SCHEMBL227735XDFBSWREOVOYSJ-UHFFFAOYSA-NDB-372311(4-Fluorophenyl)(4-methyl-4-piperidinyl)methanone(4-Fluoro-phenyl)-(4-methyl-piperidin-4-yl)-methanone78595-77-4

REACTIONS

参与反应

7 条

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-2011_10 · 10.6084/m9.figshare.5104873.v1 · US08039490B2

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uspto-grants-2011_10 · 10.6084/m9.figshare.5104873.v1 · US08039490B2

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uspto-grants-2011_10 · 10.6084/m9.figshare.5104873.v1 · US08039490B2

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uspto-grants-2013_04 · 10.6084/m9.figshare.5104873.v1 · US08415350B2

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uspto-grants-2013_04 · 10.6084/m9.figshare.5104873.v1 · US08415350B2

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uspto-grants-2013_04 · 10.6084/m9.figshare.5104873.v1 · US08415350B2

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