2-(5-fluoro-2-phenylphenyl)acetonitrile

C14H10FN — CID 46314808

IUPAC2-(5-fluoro-2-phenylphenyl)acetonitrile
SMILESN#CCc1cc(F)ccc1-c1ccccc1
InChIInChI=1S/C14H10FN/c15-13-6-7-14(12(10-13)8-9-16)11-4-2-1-3-5-11/h1-7,10H,8H2
InChIKeyVFEUSORFGQGEMS-UHFFFAOYSA-N
MW211.24 g/mol
LogP3.56
Rot. Bonds2

About 2-(5-fluoro-2-phenylphenyl)acetonitrile

2-(5-fluoro-2-phenylphenyl)acetonitrile (PubChem CID 46314808) has the molecular formula C14H10FN and a molecular weight of 211.24 g/mol. Its IUPAC name is 2-(5-fluoro-2-phenylphenyl)acetonitrile.

Molecular Properties

Compound Name2-(5-fluoro-2-phenylphenyl)acetonitrile
PubChem CID46314808
Molecular FormulaC14H10FN
Molecular Weight211.24 g/mol
Exact Mass211.08
IUPAC Name2-(5-fluoro-2-phenylphenyl)acetonitrile
SMILESN#CCc1cc(F)ccc1-c1ccccc1
InChIInChI=1S/C14H10FN/c15-13-6-7-14(12(10-13)8-9-16)11-4-2-1-3-5-11/h1-7,10H,8H2
InChIKeyVFEUSORFGQGEMS-UHFFFAOYSA-N
XLogP3.56
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(bromomethyl)-4-fluoro-1-phenylbenzene
CID 59789301
2-(2-fluoro-5-phenyl-4-pyridinyl)acetonitrile
CID 131870326
2-[5-fluoro-2-[2-(trifluoromethoxy)phenyl]phenyl]acetonitrile
CID 118822081
2-(2-fluoro-5-phenyl-3-pyridinyl)acetonitrile
CID 131870328
2-(2,3-diphenylphenyl)acetonitrile
CID 151704246
ethane;2-(5-fluoro-2-methylphenyl)acetonitrile
CID 177006757
2-[5-phenyl-2-(trifluoromethyl)-4-pyridinyl]acetonitrile
CID 133096208
(5-fluoro-2-phenylphenyl)cyanamide
CID 19089303
2-(dimethoxyphosphorylmethyl)-4-fluoro-1-phenylbenzene
CID 72735167
2-[2-[2-(3-fluorophenyl)ethynyl]phenyl]acetonitrile
CID 141385810
2-[5-(3-fluorophenyl)-2-oxo-1H-pyridin-4-yl]acetonitrile
CID 131869910
2-(cyanomethyl)-5-fluorobenzonitrile
CID 45090709

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-phenylphenyl)acetonitrile?
The IUPAC name of 2-(5-fluoro-2-phenylphenyl)acetonitrile (CID 46314808) is 2-(5-fluoro-2-phenylphenyl)acetonitrile.
What is the SMILES notation for 2-(5-fluoro-2-phenylphenyl)acetonitrile?
The canonical SMILES for 2-(5-fluoro-2-phenylphenyl)acetonitrile is N#CCc1cc(F)ccc1-c1ccccc1.
What is the InChIKey of 2-(5-fluoro-2-phenylphenyl)acetonitrile?
The InChIKey is VFEUSORFGQGEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN/c15-13-6-7-14(12(10-13)8-9-16)11-4-2-1-3-5-11/h1-7,10H,8H2.
What are the key properties of 2-(5-fluoro-2-phenylphenyl)acetonitrile?
2-(5-fluoro-2-phenylphenyl)acetonitrile has a molecular weight of 211.24 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-phenylphenyl)acetonitrile is sourced from PubChem (CID 46314808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).