3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide

C12H9ClN2O2 — CID 3011466

IUPAC3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide
SMILESO=C(Nc1cccc(=O)[nH]1)c1cccc(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-9-4-1-3-8(7-9)12(17)15-10-5-2-6-11(16)14-10/h1-7H,(H2,14,15,16,17)
InChIKeyNJMRINGFUZYVBI-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.28
Rot. Bonds2

About 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide

3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide (PubChem CID 3011466) has the molecular formula C12H9ClN2O2 and a molecular weight of 248.67 g/mol. Its IUPAC name is 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide
PubChem CID3011466
Molecular FormulaC12H9ClN2O2
Molecular Weight248.67 g/mol
Exact Mass248.04
IUPAC Name3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide
SMILESO=C(Nc1cccc(=O)[nH]1)c1cccc(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-9-4-1-3-8(7-9)12(17)15-10-5-2-6-11(16)14-10/h1-7H,(H2,14,15,16,17)
InChIKeyNJMRINGFUZYVBI-UHFFFAOYSA-N
XLogP2.28
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
3-chloro-N-(2,4,5-trichlorophenyl)benzamide
CID 854431
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
3-chloro-N-pyridin-4-ylbenzamide
CID 849128
3-chloro-N-(4-methylphenyl)benzamide
CID 722375
3,5-dichloro-4-[(3-chlorobenzoyl)amino]benzoic acid
CID 82811022
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
3-chloro-N-(4,6-dichloropyrimidin-5-yl)benzamide
CID 114074797
3-chloro-N-(4-chloro-2-pyridinyl)benzamide
CID 3011465
3-[[3-[(3-chlorobenzoyl)amino]benzoyl]amino]benzoate
CID 3383614
3-chloro-N-(2-propan-2-ylphenyl)benzamide
CID 681881
3-chloro-N-(1H-pyrazol-4-yl)benzamide
CID 43429419

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide?
The IUPAC name of 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide (CID 3011466) is 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide.
What is the SMILES notation for 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide?
The canonical SMILES for 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide is O=C(Nc1cccc(=O)[nH]1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide?
The InChIKey is NJMRINGFUZYVBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O2/c13-9-4-1-3-8(7-9)12(17)15-10-5-2-6-11(16)14-10/h1-7H,(H2,14,15,16,17).
What are the key properties of 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide?
3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide has a molecular weight of 248.67 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(6-oxo-1H-pyridin-2-yl)benzamide is sourced from PubChem (CID 3011466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).