2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile

C15H9N5O — CID 12736666

IUPAC2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile
SMILESCOc1ccc(-c2nc(N)c(C#N)c(C#N)c2C#N)cc1
InChIInChI=1S/C15H9N5O/c1-21-10-4-2-9(3-5-10)14-12(7-17)11(6-16)13(8-18)15(19)20-14/h2-5H,1H3,(H2,19,20)
InChIKeyAQIJPSZWRJVSTH-UHFFFAOYSA-N
MW275.27 g/mol
LogP1.95
Rot. Bonds2

About 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile

2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile (PubChem CID 12736666) has the molecular formula C15H9N5O and a molecular weight of 275.27 g/mol. Its IUPAC name is 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile
PubChem CID12736666
Molecular FormulaC15H9N5O
Molecular Weight275.27 g/mol
Exact Mass275.08
IUPAC Name2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile
SMILESCOc1ccc(-c2nc(N)c(C#N)c(C#N)c2C#N)cc1
InChIInChI=1S/C15H9N5O/c1-21-10-4-2-9(3-5-10)14-12(7-17)11(6-16)13(8-18)15(19)20-14/h2-5H,1H3,(H2,19,20)
InChIKeyAQIJPSZWRJVSTH-UHFFFAOYSA-N
XLogP1.95
TPSA119.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile 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-[4-(4-methoxyphenoxy)phenyl]pyridine-3,4,5-tricarbonitrile
CID 1488060
3-amino-1-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
CID 23823826
2-amino-5-ethyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
CID 856266
2-amino-4-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)-5-methylpyridine-3-carbonitrile
CID 3308725
4-amino-2-methoxy-6-phenylpyrimidine-5-carbonitrile
CID 12862277
3-amino-5-(4-methoxyphenyl)-1,2-oxazole-4-carbonitrile
CID 83704376
2-amino-6-ethylsulfanyl-4-(4-methoxyphenyl)pyridine-3,5-dicarbonitrile
CID 12826099
4-amino-6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
CID 11572440
2-amino-4-(4-methoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 70111563
2-amino-6-tert-butyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 17384299
2-amino-4-(3-methoxyphenyl)-6-phenylpyrimidine-5-carbonitrile
CID 163196347
2-amino-6-(2-hydroxyethylsulfanyl)-4-(4-methoxyphenyl)pyridine-3,5-dicarbonitrile
CID 11255849

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile?
The IUPAC name of 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile (CID 12736666) is 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile.
What is the SMILES notation for 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile?
The canonical SMILES for 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile is COc1ccc(-c2nc(N)c(C#N)c(C#N)c2C#N)cc1.
What is the InChIKey of 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile?
The InChIKey is AQIJPSZWRJVSTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N5O/c1-21-10-4-2-9(3-5-10)14-12(7-17)11(6-16)13(8-18)15(19)20-14/h2-5H,1H3,(H2,19,20).
What are the key properties of 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile?
2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile has a molecular weight of 275.27 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-methoxyphenyl)pyridine-3,4,5-tricarbonitrile is sourced from PubChem (CID 12736666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).