2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile

C15H14FN3O — CID 94280993

IUPAC2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile
SMILESCOc1ccc(F)cc1-c1ccc(C#N)c(N(C)C)n1
InChIInChI=1S/C15H14FN3O/c1-19(2)15-10(9-17)4-6-13(18-15)12-8-11(16)5-7-14(12)20-3/h4-8H,1-3H3
InChIKeyJETBKPKSWURGHA-UHFFFAOYSA-N
MW271.30 g/mol
LogP2.83
Rot. Bonds3

About 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile

2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile (PubChem CID 94280993) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile
PubChem CID94280993
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile
SMILESCOc1ccc(F)cc1-c1ccc(C#N)c(N(C)C)n1
InChIInChI=1S/C15H14FN3O/c1-19(2)15-10(9-17)4-6-13(18-15)12-8-11(16)5-7-14(12)20-3/h4-8H,1-3H3
InChIKeyJETBKPKSWURGHA-UHFFFAOYSA-N
XLogP2.83
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-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

6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile
CID 82453336
2-chloro-6-(5-fluoro-2-methoxyphenyl)-5-methylpyridine-3-carbonitrile
CID 94285487
6-(5-fluoro-2-methoxyphenyl)pyridin-2-amine
CID 61026023
4-fluoro-2-(4-methoxyphenyl)benzonitrile
CID 67042916
2-[2-(dimethylamino)-2-methylpropoxy]-5-fluorobenzonitrile
CID 79679477
4-(5-fluoro-2-methoxyphenyl)imidazole-1,2-diamine
CID 82286848
2-(5-fluoro-2-methoxy-N-methylanilino)propanenitrile
CID 115129963
2-[5,6-bis(dimethylamino)-2-pyridinyl]-4-methylbenzonitrile
CID 123987139
6-chloro-2-(dimethylamino)pyridine-3-carbonitrile
CID 178072823
6-(2,5-dimethoxyphenyl)-2-(dimethylamino)pyridine-3-carboxylic acid
CID 94313799
5-(5-fluoro-2-methoxyphenyl)-1,2,4-triazin-3-amine
CID 82392808
5-[(2-amino-5-fluorophenyl)sulfanylmethyl]-2-methoxybenzonitrile
CID 79147816

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile (CID 94280993) is 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile is COc1ccc(F)cc1-c1ccc(C#N)c(N(C)C)n1.
What is the InChIKey of 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile?
The InChIKey is JETBKPKSWURGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c1-19(2)15-10(9-17)4-6-13(18-15)12-8-11(16)5-7-14(12)20-3/h4-8H,1-3H3.
What are the key properties of 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile?
2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile has a molecular weight of 271.30 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 94280993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).