2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide

C21H16N4O3 — CID 109093044

IUPAC2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(C#N)cc3)c2)c1
InChIInChI=1S/C21H16N4O3/c1-28-18-4-2-3-17(12-18)25-20(26)15-9-10-23-19(11-15)21(27)24-16-7-5-14(13-22)6-8-16/h2-12H,1H3,(H,24,27)(H,25,26)
InChIKeyARJMWQIFMKWGGG-UHFFFAOYSA-N
MW372.38 g/mol
LogP3.47
Rot. Bonds5

About 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide

2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109093044) has the molecular formula C21H16N4O3 and a molecular weight of 372.38 g/mol. Its IUPAC name is 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109093044
Molecular FormulaC21H16N4O3
Molecular Weight372.38 g/mol
Exact Mass372.12
IUPAC Name2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(C#N)cc3)c2)c1
InChIInChI=1S/C21H16N4O3/c1-28-18-4-2-3-17(12-18)25-20(26)15-9-10-23-19(11-15)21(27)24-16-7-5-14(13-22)6-8-16/h2-12H,1H3,(H,24,27)(H,25,26)
InChIKeyARJMWQIFMKWGGG-UHFFFAOYSA-N
XLogP3.47
TPSA104.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(4-acetamidophenyl)-2-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109093227
N-(4-cyanophenyl)-2-(3-methoxyanilino)pyrimidine-4-carboxamide
CID 109317646
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093066
2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092970
4-N-(4-cyanophenyl)-2-N-(2,6-diethylphenyl)pyridine-2,4-dicarboxamide
CID 109092546
3-cyano-N-(3-methoxyphenyl)benzamide
CID 2709744
N-(4-cyanophenyl)-N'-(3-methoxyphenyl)oxamide
CID 108519400
2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093072
4-N-(3-cyanophenyl)-2-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109093258
2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091016
1-N-(3-cyanophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057633

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (CID 109093044) is 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is COc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(C#N)cc3)c2)c1.
What is the InChIKey of 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is ARJMWQIFMKWGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O3/c1-28-18-4-2-3-17(12-18)25-20(26)15-9-10-23-19(11-15)21(27)24-16-7-5-14(13-22)6-8-16/h2-12H,1H3,(H,24,27)(H,25,26).
What are the key properties of 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 372.38 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109093044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).