3-chloro-4-(2-oxo-1-pyridinyl)benzamide

C12H9ClN2O2 — CID 67481316

IUPAC3-chloro-4-(2-oxo-1-pyridinyl)benzamide
SMILESNC(=O)c1ccc(-n2ccccc2=O)c(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-9-7-8(12(14)17)4-5-10(9)15-6-2-1-3-11(15)16/h1-7H,(H2,14,17)
InChIKeyQIWMWKLESPVHQL-UHFFFAOYSA-N
MW248.67 g/mol
LogP1.59
Rot. Bonds2

About 3-chloro-4-(2-oxo-1-pyridinyl)benzamide

3-chloro-4-(2-oxo-1-pyridinyl)benzamide (PubChem CID 67481316) has the molecular formula C12H9ClN2O2 and a molecular weight of 248.67 g/mol. Its IUPAC name is 3-chloro-4-(2-oxo-1-pyridinyl)benzamide.

Molecular Properties

Compound Name3-chloro-4-(2-oxo-1-pyridinyl)benzamide
PubChem CID67481316
Molecular FormulaC12H9ClN2O2
Molecular Weight248.67 g/mol
Exact Mass248.04
IUPAC Name3-chloro-4-(2-oxo-1-pyridinyl)benzamide
SMILESNC(=O)c1ccc(-n2ccccc2=O)c(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-9-7-8(12(14)17)4-5-10(9)15-6-2-1-3-11(15)16/h1-7H,(H2,14,17)
InChIKeyQIWMWKLESPVHQL-UHFFFAOYSA-N
XLogP1.59
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-(2-oxo-1-pyridinyl)benzamide?
The IUPAC name of 3-chloro-4-(2-oxo-1-pyridinyl)benzamide (CID 67481316) is 3-chloro-4-(2-oxo-1-pyridinyl)benzamide.
What is the SMILES notation for 3-chloro-4-(2-oxo-1-pyridinyl)benzamide?
The canonical SMILES for 3-chloro-4-(2-oxo-1-pyridinyl)benzamide is NC(=O)c1ccc(-n2ccccc2=O)c(Cl)c1.
What is the InChIKey of 3-chloro-4-(2-oxo-1-pyridinyl)benzamide?
The InChIKey is QIWMWKLESPVHQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O2/c13-9-7-8(12(14)17)4-5-10(9)15-6-2-1-3-11(15)16/h1-7H,(H2,14,17).
What are the key properties of 3-chloro-4-(2-oxo-1-pyridinyl)benzamide?
3-chloro-4-(2-oxo-1-pyridinyl)benzamide has a molecular weight of 248.67 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-(2-oxo-1-pyridinyl)benzamide is sourced from PubChem (CID 67481316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).