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

C12H10ClN3O2 — CID 61041355

IUPAC2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
SMILESCn1cc(NC(=O)c2cccnc2Cl)ccc1=O
InChIInChI=1S/C12H10ClN3O2/c1-16-7-8(4-5-10(16)17)15-12(18)9-3-2-6-14-11(9)13/h2-7H,1H3,(H,15,18)
InChIKeyNNRPILRWCKMBBX-UHFFFAOYSA-N
MW263.68 g/mol
LogP1.69
Rot. Bonds2

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

2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide (PubChem CID 61041355) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
PubChem CID61041355
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC Name2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
SMILESCn1cc(NC(=O)c2cccnc2Cl)ccc1=O
InChIInChI=1S/C12H10ClN3O2/c1-16-7-8(4-5-10(16)17)15-12(18)9-3-2-6-14-11(9)13/h2-7H,1H3,(H,15,18)
InChIKeyNNRPILRWCKMBBX-UHFFFAOYSA-N
XLogP1.69
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,5-dichloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-4-carboxamide
CID 114917371
N-(4-bromophenyl)-2-chloropyridine-3-carboxamide
CID 4604195
2-chloro-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 4063614
6-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-2-carboxamide
CID 62234899
2,4-dichloro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
CID 110725053
2-fluoro-3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
CID 80718081
N-[4-(acetylcarbamothioylamino)phenyl]-2-chloropyridine-3-carboxamide
CID 930095
2-chloro-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-3-carboxamide
CID 61052437
6-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyrazine-2-carboxamide
CID 103187156
2-chloro-N-(2-methyltetrazol-5-yl)pyridine-3-carboxamide
CID 938393
2-chloro-N-(5-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 103738978
2-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
CID 61072257

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide (CID 61041355) is 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide is Cn1cc(NC(=O)c2cccnc2Cl)ccc1=O.
What is the InChIKey of 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide?
The InChIKey is NNRPILRWCKMBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-16-7-8(4-5-10(16)17)15-12(18)9-3-2-6-14-11(9)13/h2-7H,1H3,(H,15,18).
What are the key properties of 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide?
2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide has a molecular weight of 263.68 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-methyl-6-oxo-3-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 61041355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).