N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide

C24H25N3O3 — CID 53119324

IUPACN-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
SMILESCCC(C)NC(=O)c1cccn(-c2ccc(NC(=O)c3cccc(C)c3)cc2)c1=O
InChIInChI=1S/C24H25N3O3/c1-4-17(3)25-23(29)21-9-6-14-27(24(21)30)20-12-10-19(11-13-20)26-22(28)18-8-5-7-16(2)15-18/h5-15,17H,4H2,1-3H3,(H,25,29)(H,26,28)
InChIKeyUARZYBAQULXYPY-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.93
Rot. Bonds6

About N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide

N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide (PubChem CID 53119324) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
PubChem CID53119324
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
SMILESCCC(C)NC(=O)c1cccn(-c2ccc(NC(=O)c3cccc(C)c3)cc2)c1=O
InChIInChI=1S/C24H25N3O3/c1-4-17(3)25-23(29)21-9-6-14-27(24(21)30)20-12-10-19(11-13-20)26-22(28)18-8-5-7-16(2)15-18/h5-15,17H,4H2,1-3H3,(H,25,29)(H,26,28)
InChIKeyUARZYBAQULXYPY-UHFFFAOYSA-N
XLogP3.93
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxo-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 53119403
N-[(4-fluorophenyl)methyl]-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
CID 53119399
1-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxo-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 46388387
N-[4-[[2-[3-(butan-2-ylcarbamoyl)anilino]-2-oxoethyl]amino]phenyl]-3-methylbenzamide
CID 54840381
1-(4-benzamidophenyl)-N-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 53119434
1-[4-[(2-methylbenzoyl)amino]phenyl]-2-oxo-N-(1-phenylethyl)pyridine-3-carboxamide
CID 53119353
1-[4-(2,2-dimethylpropanoylamino)phenyl]-2-oxo-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 53119404
3-N-butan-2-yl-1-N-(4-ethylphenyl)benzene-1,3-dicarboxamide
CID 109051525
N-[(2S)-butan-2-yl]-3-[(4-methylbenzoyl)amino]benzamide
CID 42427411
3-N-butan-2-yl-1-N-[4-(4-methylpiperidin-1-yl)phenyl]benzene-1,3-dicarboxamide
CID 109051577
N-[(4-fluorophenyl)methyl]-1-[4-[(4-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
CID 53119397
N-[3-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2-methylbenzamide
CID 42427396

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide (CID 53119324) is N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide is CCC(C)NC(=O)c1cccn(-c2ccc(NC(=O)c3cccc(C)c3)cc2)c1=O.
What is the InChIKey of N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide?
The InChIKey is UARZYBAQULXYPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-4-17(3)25-23(29)21-9-6-14-27(24(21)30)20-12-10-19(11-13-20)26-22(28)18-8-5-7-16(2)15-18/h5-15,17H,4H2,1-3H3,(H,25,29)(H,26,28).
What are the key properties of N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide?
N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide has a molecular weight of 403.48 g/mol, XLogP of 3.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-1-[4-[(3-methylbenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 53119324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).