6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile

C20H15FN2O — CID 165017250

IUPAC6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
SMILESCOc1nc(-c2ccccc2F)cc(-c2ccc(C)cc2)c1C#N
InChIInChI=1S/C20H15FN2O/c1-13-7-9-14(10-8-13)16-11-19(15-5-3-4-6-18(15)21)23-20(24-2)17(16)12-22/h3-11H,1-2H3
InChIKeyKPRCXPXMKJEESL-UHFFFAOYSA-N
MW318.35 g/mol
LogP4.74
Rot. Bonds3

About 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile

6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile (PubChem CID 165017250) has the molecular formula C20H15FN2O and a molecular weight of 318.35 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
PubChem CID165017250
Molecular FormulaC20H15FN2O
Molecular Weight318.35 g/mol
Exact Mass318.12
IUPAC Name6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
SMILESCOc1nc(-c2ccccc2F)cc(-c2ccc(C)cc2)c1C#N
InChIInChI=1S/C20H15FN2O/c1-13-7-9-14(10-8-13)16-11-19(15-5-3-4-6-18(15)21)23-20(24-2)17(16)12-22/h3-11H,1-2H3
InChIKeyKPRCXPXMKJEESL-UHFFFAOYSA-N
XLogP4.74
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-azulen-1-yl-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 10641600
2-amino-6-(2-fluorophenyl)-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 5119022
4-(4-chlorophenyl)-6-(2-hydroxy-3-oxocyclohepta-1,4,6-trien-1-yl)-2-methoxypyridine-3-carbonitrile
CID 135753499
2-amino-6-(2-fluorophenyl)-4-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5119728
6-(3-chloro-2-pyridinyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 164955818
4-[4-(3-cyano-2-methoxy-6-thiophen-2-yl-4-pyridinyl)phenyl]-2-methoxy-6-thiophen-2-ylpyridine-3-carbonitrile
CID 14950544
4-[4-[3-cyano-6-(furan-2-yl)-2-methoxy-4-pyridinyl]phenyl]-6-(furan-2-yl)-2-methoxypyridine-3-carbonitrile
CID 14950543
4-(4-fluorophenyl)-2-methoxy-6-(3-methoxy-2-pyridinyl)pyridine-3-carbonitrile
CID 154644718
4-(2-hydroxyphenyl)-2-methoxy-6-phenylpyridine-3-carbonitrile
CID 135692578
2-methoxy-4-naphthalen-1-yl-6-phenylpyridine-3-carbonitrile
CID 14066095
2-amino-6-(2-fluorophenyl)-4-(2,4,6-trimethoxyphenyl)pyridine-3-carbonitrile
CID 5119568
N-[4-(5-cyano-6-methoxy-4-phenyl-2-pyridinyl)phenyl]acetamide
CID 70924863

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile?
The IUPAC name of 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile (CID 165017250) is 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile is COc1nc(-c2ccccc2F)cc(-c2ccc(C)cc2)c1C#N.
What is the InChIKey of 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile?
The InChIKey is KPRCXPXMKJEESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O/c1-13-7-9-14(10-8-13)16-11-19(15-5-3-4-6-18(15)21)23-20(24-2)17(16)12-22/h3-11H,1-2H3.
What are the key properties of 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile?
6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile has a molecular weight of 318.35 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-2-methoxy-4-(4-methylphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 165017250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).