1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

C19H18N4O3 — CID 126675335

IUPAC1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc(C#N)c2)c1=O
InChIInChI=1S/C19H18N4O3/c1-21-18(25)16-8-14(17(24)22-15-5-6-15)11-23(19(16)26)10-13-4-2-3-12(7-13)9-20/h2-4,7-8,11,15H,5-6,10H2,1H3,(H,21,25)(H,22,24)
InChIKeyPMXVFVBZVAKKGS-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.02
Rot. Bonds5

About 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (PubChem CID 126675335) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
PubChem CID126675335
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc(C#N)c2)c1=O
InChIInChI=1S/C19H18N4O3/c1-21-18(25)16-8-14(17(24)22-15-5-6-15)11-23(19(16)26)10-13-4-2-3-12(7-13)9-20/h2-4,7-8,11,15H,5-6,10H2,1H3,(H,21,25)(H,22,24)
InChIKeyPMXVFVBZVAKKGS-UHFFFAOYSA-N
XLogP1.02
TPSA103.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide 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

1-Benzyl-N5-cyclopropyl-N3-methyl-2-oxo-1,2-dihydropyridine-3,5-dicarboxamide
CID 126648559
5-N-cyclopropyl-3-N-methyl-2-oxo-1-[(1R)-1-phenylethyl]pyridine-3,5-dicarboxamide
CID 126676281
N-benzyl-1-butyl-6-ethyl-5-methyl-2-oxopyridine-3-carboxamide
CID 23588031
N-((2-hydroxy-4,6-dimethylpyridin-3-yl)methyl)-2-oxo-1-(1-phenylethyl)-1,2-dihydropyridine-4-carboxamide
CID 71571201
5-N-cyclopropyl-1-[(2-fluorophenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126648589
1-benzyl-5-N-cyclobutyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126648780
5-N-cyclopropyl-1-[(4-fluorophenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126648792
5-N-cyclopropyl-1-[(3-fluorophenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126648895
1-benzyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126675255
1-benzyl-5-N-ethyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126675974
5-N-cyclopropyl-3-N-methyl-1-[(3-methylphenyl)methyl]-2-oxopyridine-3,5-dicarboxamide
CID 126676006
1-benzyl-3-N,5-N-dimethyl-2-oxopyridine-3,5-dicarboxamide
CID 129022870

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The IUPAC name of 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (CID 126675335) is 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.
What is the SMILES notation for 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The canonical SMILES for 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is CNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2cccc(C#N)c2)c1=O.
What is the InChIKey of 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The InChIKey is PMXVFVBZVAKKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-21-18(25)16-8-14(17(24)22-15-5-6-15)11-23(19(16)26)10-13-4-2-3-12(7-13)9-20/h2-4,7-8,11,15H,5-6,10H2,1H3,(H,21,25)(H,22,24).
What are the key properties of 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide has a molecular weight of 350.38 g/mol, XLogP of 1.02, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyanophenyl)methyl]-5-N-cyclopropyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is sourced from PubChem (CID 126675335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).