1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide

C22H19N3O3 — CID 53119413

IUPAC1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccc(C(=O)NC3CC3)c2=O)cc1)c1ccccc1
InChIInChI=1S/C22H19N3O3/c26-20(15-5-2-1-3-6-15)23-17-10-12-18(13-11-17)25-14-4-7-19(22(25)28)21(27)24-16-8-9-16/h1-7,10-14,16H,8-9H2,(H,23,26)(H,24,27)
InChIKeyVCCDBQWTQIXCKR-UHFFFAOYSA-N
MW373.41 g/mol
LogP2.98
Rot. Bonds5

About 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide

1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide (PubChem CID 53119413) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide
PubChem CID53119413
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccc(C(=O)NC3CC3)c2=O)cc1)c1ccccc1
InChIInChI=1S/C22H19N3O3/c26-20(15-5-2-1-3-6-15)23-17-10-12-18(13-11-17)25-14-4-7-19(22(25)28)21(27)24-16-8-9-16/h1-7,10-14,16H,8-9H2,(H,23,26)(H,24,27)
InChIKeyVCCDBQWTQIXCKR-UHFFFAOYSA-N
XLogP2.98
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-benzamidophenyl)-N-cyclohexyl-2-oxopyridine-3-carboxamide
CID 53119460
1-[4-[(4-fluorobenzoyl)amino]phenyl]-N-(4-methylcyclohexyl)-2-oxopyridine-3-carboxamide
CID 53119378
N-cyclohexyl-1-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
CID 53119458
1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide
CID 53119333
1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cycloheptyl-2-oxopyridine-3-carboxamide
CID 53119327
1-(4-benzamidophenyl)-N-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 53119434
4-benzamido-N-cyclopentylbenzamide
CID 1262350
1-[4-[(4-methylbenzoyl)amino]phenyl]-2-oxo-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 95089029
1-(4-acetamidophenyl)-N-methyl-2-oxopyridine-3-carboxamide
CID 20974500
4-(cyclopropylcarbamoylamino)-N-phenylbenzamide
CID 39885806
1-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxo-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 46388387
1-[4-[(2-chlorobenzoyl)amino]phenyl]-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 95089028

Frequently Asked Questions

What is the IUPAC name of 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide (CID 53119413) is 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide is O=C(Nc1ccc(-n2cccc(C(=O)NC3CC3)c2=O)cc1)c1ccccc1.
What is the InChIKey of 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide?
The InChIKey is VCCDBQWTQIXCKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c26-20(15-5-2-1-3-6-15)23-17-10-12-18(13-11-17)25-14-4-7-19(22(25)28)21(27)24-16-8-9-16/h1-7,10-14,16H,8-9H2,(H,23,26)(H,24,27).
What are the key properties of 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide?
1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide has a molecular weight of 373.41 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 53119413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).