N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide

C12H10ClN3O2 — CID 113253464

IUPACN-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2ccc[nH]c2=O)cnc1Cl
InChIInChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-10(7)13)16-12(18)9-3-2-4-14-11(9)17/h2-6H,1H3,(H,14,17)(H,16,18)
InChIKeyKLJADAMMQPATMT-UHFFFAOYSA-N
MW263.68 g/mol
LogP1.98
Rot. Bonds2

About N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide

N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 113253464) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID113253464
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2ccc[nH]c2=O)cnc1Cl
InChIInChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-10(7)13)16-12(18)9-3-2-4-14-11(9)17/h2-6H,1H3,(H,14,17)(H,16,18)
InChIKeyKLJADAMMQPATMT-UHFFFAOYSA-N
XLogP1.98
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide 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

5-chloro-N-(6-chloro-5-methyl-3-pyridinyl)-2-methylbenzamide
CID 103842318
N-(3,4-dichlorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 110692742
N-(6-chloro-5-methyl-3-pyridinyl)-2-fluoropyridine-3-carboxamide
CID 107363154
N-(3,5-dichlorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 110692745
N-(2-methyl-4-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide
CID 110692738
N-(6-chloro-5-methyl-3-pyridinyl)-2-fluoro-5-methylbenzamide
CID 113250442
2-bromo-5-chloro-N-(6-chloro-5-methyl-3-pyridinyl)benzamide
CID 103745291
2-bromo-N-(6-chloro-5-methyl-3-pyridinyl)furan-3-carboxamide
CID 107091817
N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 103730447
N-(3-chloro-4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 64787521
N-(6-chloro-5-methyl-3-pyridinyl)-3-fluoropyridine-4-carboxamide
CID 103745275
2-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-5-fluorobenzamide
CID 113250431

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide (CID 113253464) is N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide is Cc1cc(NC(=O)c2ccc[nH]c2=O)cnc1Cl.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is KLJADAMMQPATMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-7-5-8(6-15-10(7)13)16-12(18)9-3-2-4-14-11(9)17/h2-6H,1H3,(H,14,17)(H,16,18).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide?
N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 263.68 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-methyl-3-pyridinyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 113253464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).