3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile

C18H10F2N2 — CID 172968789

IUPAC3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile
SMILESN#Cc1nc(-c2ccc(-c3ccccc3)cc2F)ccc1F
InChIInChI=1S/C18H10F2N2/c19-15-8-9-17(22-18(15)11-21)14-7-6-13(10-16(14)20)12-4-2-1-3-5-12/h1-10H
InChIKeyRGEPODUGVIUNAE-UHFFFAOYSA-N
MW292.29 g/mol
LogP4.57
Rot. Bonds2

About 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile

3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile (PubChem CID 172968789) has the molecular formula C18H10F2N2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile
PubChem CID172968789
Molecular FormulaC18H10F2N2
Molecular Weight292.29 g/mol
Exact Mass292.08
IUPAC Name3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile
SMILESN#Cc1nc(-c2ccc(-c3ccccc3)cc2F)ccc1F
InChIInChI=1S/C18H10F2N2/c19-15-8-9-17(22-18(15)11-21)14-7-6-13(10-16(14)20)12-4-2-1-3-5-12/h1-10H
InChIKeyRGEPODUGVIUNAE-UHFFFAOYSA-N
XLogP4.57
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile?
The IUPAC name of 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile (CID 172968789) is 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile.
What is the SMILES notation for 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile?
The canonical SMILES for 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile is N#Cc1nc(-c2ccc(-c3ccccc3)cc2F)ccc1F.
What is the InChIKey of 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile?
The InChIKey is RGEPODUGVIUNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F2N2/c19-15-8-9-17(22-18(15)11-21)14-7-6-13(10-16(14)20)12-4-2-1-3-5-12/h1-10H.
What are the key properties of 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile?
3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile has a molecular weight of 292.29 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-(2-fluoro-4-phenylphenyl)pyridine-2-carbonitrile is sourced from PubChem (CID 172968789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).