2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile

C13H10FN3 — CID 4632780

IUPAC2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile
SMILESCc1cc(-c2cccc(F)c2)c(C#N)c(N)n1
InChIInChI=1S/C13H10FN3/c1-8-5-11(12(7-15)13(16)17-8)9-3-2-4-10(14)6-9/h2-6H,1H3,(H2,16,17)
InChIKeyRPERVENIHBOGHU-UHFFFAOYSA-N
MW227.24 g/mol
LogP2.65
Rot. Bonds1

About 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile

2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile (PubChem CID 4632780) has the molecular formula C13H10FN3 and a molecular weight of 227.24 g/mol. Its IUPAC name is 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile
PubChem CID4632780
Molecular FormulaC13H10FN3
Molecular Weight227.24 g/mol
Exact Mass227.09
IUPAC Name2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile
SMILESCc1cc(-c2cccc(F)c2)c(C#N)c(N)n1
InChIInChI=1S/C13H10FN3/c1-8-5-11(12(7-15)13(16)17-8)9-3-2-4-10(14)6-9/h2-6H,1H3,(H2,16,17)
InChIKeyRPERVENIHBOGHU-UHFFFAOYSA-N
XLogP2.65
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-6-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile
CID 4632984
2-amino-4-(3-fluorophenyl)-6-(2-methylphenyl)pyridine-3-carbonitrile
CID 5230179
2-amino-6-(3-fluorophenyl)-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 5118241
2-amino-4-(3-fluorophenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 3369926
2-amino-4-(2,5-dimethylphenyl)-6-(3-fluorophenyl)pyridine-3-carbonitrile
CID 5118538
2-amino-6-(2,5-dimethoxyphenyl)-4-(3-fluorophenyl)pyridine-3-carbonitrile
CID 3548331
2-amino-4-(2-fluorophenyl)-6-(3-fluorophenyl)pyridine-3-carbonitrile
CID 5118076
2-amino-4-(3,4-dimethoxyphenyl)-6-methylpyridine-3-carbonitrile
CID 856329
2-amino-6-(3-fluorophenyl)-4-(2-methoxyphenyl)pyridine-3-carbonitrile
CID 5118237
2-amino-6-(3-fluorophenyl)-4-thiophen-2-ylpyridine-3-carbonitrile
CID 5118720
2-amino-6-(3-fluorophenyl)-4-(2,3,4-trimethoxyphenyl)pyridine-3-carbonitrile
CID 5118716
2-amino-5-(3-fluorophenyl)-4-methylthiophene-3-carbonitrile
CID 114830933

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile (CID 4632780) is 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile is Cc1cc(-c2cccc(F)c2)c(C#N)c(N)n1.
What is the InChIKey of 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile?
The InChIKey is RPERVENIHBOGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3/c1-8-5-11(12(7-15)13(16)17-8)9-3-2-4-10(14)6-9/h2-6H,1H3,(H2,16,17).
What are the key properties of 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile?
2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile has a molecular weight of 227.24 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(3-fluorophenyl)-6-methylpyridine-3-carbonitrile is sourced from PubChem (CID 4632780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).