2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide

C13H10BrClN2O2 — CID 86813420

IUPAC2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide
SMILESCn1cccc(NC(=O)c2ccc(Cl)cc2Br)c1=O
InChIInChI=1S/C13H10BrClN2O2/c1-17-6-2-3-11(13(17)19)16-12(18)9-5-4-8(15)7-10(9)14/h2-7H,1H3,(H,16,18)
InChIKeyQSBOYYIMVGRGPP-UHFFFAOYSA-N
MW341.59 g/mol
LogP3.05
Rot. Bonds2

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

2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide (PubChem CID 86813420) has the molecular formula C13H10BrClN2O2 and a molecular weight of 341.59 g/mol. Its IUPAC name is 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide
PubChem CID86813420
Molecular FormulaC13H10BrClN2O2
Molecular Weight341.59 g/mol
Exact Mass339.96
IUPAC Name2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide
SMILESCn1cccc(NC(=O)c2ccc(Cl)cc2Br)c1=O
InChIInChI=1S/C13H10BrClN2O2/c1-17-6-2-3-11(13(17)19)16-12(18)9-5-4-8(15)7-10(9)14/h2-7H,1H3,(H,16,18)
InChIKeyQSBOYYIMVGRGPP-UHFFFAOYSA-N
XLogP3.05
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.59
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide
CID 86768884
2-bromo-4-chloro-N-(2-chlorophenyl)benzamide
CID 103763135
methyl 2-[(2-bromo-4-chlorobenzoyl)amino]benzoate
CID 103763170
2-[(2-bromo-4-chlorobenzoyl)amino]-6-methylbenzoic acid
CID 107986716
2-bromo-N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide
CID 113257224
2-bromo-N-(4-bromo-2-fluorophenyl)-4-chlorobenzamide
CID 103763204
2-bromo-4-chloro-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 107989011
2-bromo-4-chloro-N-(2-chloro-4-iodophenyl)benzamide
CID 114024506
N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
2-bromo-4-chloro-N-(4-methylphenyl)benzamide
CID 103763138
2-bromo-4-chloro-N-(2,6-difluorophenyl)benzamide
CID 113257211
2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide?
The IUPAC name of 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide (CID 86813420) is 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide.
What is the SMILES notation for 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide?
The canonical SMILES for 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide is Cn1cccc(NC(=O)c2ccc(Cl)cc2Br)c1=O.
What is the InChIKey of 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide?
The InChIKey is QSBOYYIMVGRGPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrClN2O2/c1-17-6-2-3-11(13(17)19)16-12(18)9-5-4-8(15)7-10(9)14/h2-7H,1H3,(H,16,18).
What are the key properties of 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide?
2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide has a molecular weight of 341.59 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-N-(1-methyl-2-oxo-3-pyridinyl)benzamide is sourced from PubChem (CID 86813420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).