1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide

C24H22ClN3O3 — CID 53119333

IUPAC1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccc(C(=O)NC3CCCC3)c2=O)cc1)c1ccccc1Cl
InChIInChI=1S/C24H22ClN3O3/c25-21-10-4-3-8-19(21)22(29)27-17-11-13-18(14-12-17)28-15-5-9-20(24(28)31)23(30)26-16-6-1-2-7-16/h3-5,8-16H,1-2,6-7H2,(H,26,30)(H,27,29)
InChIKeyQLLWWMXYEVFJKC-UHFFFAOYSA-N
MW435.91 g/mol
LogP4.42
Rot. Bonds5

About 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide

1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide (PubChem CID 53119333) has the molecular formula C24H22ClN3O3 and a molecular weight of 435.91 g/mol. Its IUPAC name is 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide
PubChem CID53119333
Molecular FormulaC24H22ClN3O3
Molecular Weight435.91 g/mol
Exact Mass435.13
IUPAC Name1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-n2cccc(C(=O)NC3CCCC3)c2=O)cc1)c1ccccc1Cl
InChIInChI=1S/C24H22ClN3O3/c25-21-10-4-3-8-19(21)22(29)27-17-11-13-18(14-12-17)28-15-5-9-20(24(28)31)23(30)26-16-6-1-2-7-16/h3-5,8-16H,1-2,6-7H2,(H,26,30)(H,27,29)
InChIKeyQLLWWMXYEVFJKC-UHFFFAOYSA-N
XLogP4.42
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.91
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cycloheptyl-2-oxopyridine-3-carboxamide
CID 53119327
1-(4-benzamidophenyl)-N-cyclohexyl-2-oxopyridine-3-carboxamide
CID 53119460
1-(4-benzamidophenyl)-N-cyclopropyl-2-oxopyridine-3-carboxamide
CID 53119413
N-cyclohexyl-1-[4-[(4-fluorobenzoyl)amino]phenyl]-2-oxopyridine-3-carboxamide
CID 53119458
1-[4-[(2-chlorobenzoyl)amino]phenyl]-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 95089028
2-chloro-N-cyclopentylbenzamide
CID 669043
1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-[(2-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 53119420
1-[4-[(4-fluorobenzoyl)amino]phenyl]-N-(4-methylcyclohexyl)-2-oxopyridine-3-carboxamide
CID 53119378
1-[4-[(2-fluorobenzoyl)amino]phenyl]-N-methyl-2-oxopyridine-3-carboxamide
CID 53119471
2-chloro-N-cycloheptylbenzamide;pyrrolidine
CID 143233402
1-[4-[(2-chlorobenzoyl)amino]benzoyl]-N-cycloheptylpiperidine-3-carboxamide
CID 46384471
1-(4-acetamidophenyl)-N-methyl-2-oxopyridine-3-carboxamide
CID 20974500

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide (CID 53119333) is 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide is O=C(Nc1ccc(-n2cccc(C(=O)NC3CCCC3)c2=O)cc1)c1ccccc1Cl.
What is the InChIKey of 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide?
The InChIKey is QLLWWMXYEVFJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN3O3/c25-21-10-4-3-8-19(21)22(29)27-17-11-13-18(14-12-17)28-15-5-9-20(24(28)31)23(30)26-16-6-1-2-7-16/h3-5,8-16H,1-2,6-7H2,(H,26,30)(H,27,29).
What are the key properties of 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide?
1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide has a molecular weight of 435.91 g/mol, XLogP of 4.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-chlorobenzoyl)amino]phenyl]-N-cyclopentyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 53119333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).