5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide

C13H10Br2N2O — CID 43806322

IUPAC5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(Br)cc1NC(=O)c1cncc(Br)c1
InChIInChI=1S/C13H10Br2N2O/c1-8-2-3-10(14)5-12(8)17-13(18)9-4-11(15)7-16-6-9/h2-7H,1H3,(H,17,18)
InChIKeyHTSZMAKPTQLEGU-UHFFFAOYSA-N
MW370.04 g/mol
LogP4.17
Rot. Bonds2

About 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide

5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide (PubChem CID 43806322) has the molecular formula C13H10Br2N2O and a molecular weight of 370.04 g/mol. Its IUPAC name is 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide
PubChem CID43806322
Molecular FormulaC13H10Br2N2O
Molecular Weight370.04 g/mol
Exact Mass367.92
IUPAC Name5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(Br)cc1NC(=O)c1cncc(Br)c1
InChIInChI=1S/C13H10Br2N2O/c1-8-2-3-10(14)5-12(8)17-13(18)9-4-11(15)7-16-6-9/h2-7H,1H3,(H,17,18)
InChIKeyHTSZMAKPTQLEGU-UHFFFAOYSA-N
XLogP4.17
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.04
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]pyridine-3-carboxamide
CID 46475612
5-bromo-N-[5-[(2,4-dimethylphenyl)sulfamoyl]-2-methylphenyl]pyridine-3-carboxamide
CID 5225975
N-(5-bromo-2-methylphenyl)-4-methylbenzamide
CID 43806352
5-bromo-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]pyridine-3-carboxamide
CID 28675294
N-(5-bromo-2-methylphenyl)-6-chloropyrazine-2-carboxamide
CID 103337254
5-bromo-N-(2-fluoro-5-methylphenyl)pyridine-3-carboxamide
CID 26881964
N-(5-bromo-2-methylphenyl)-3-hydroxy-4-methylbenzamide
CID 43806148
5-bromo-N-(4-bromo-3,5-dimethylphenyl)pyridine-3-carboxamide
CID 107574886
5-bromo-N-(4-ethoxy-2-methylphenyl)pyridine-3-carboxamide
CID 47312097
N-(4-bromo-2-methylphenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239464
5-bromo-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]pyridine-3-carboxamide
CID 122283713
N-(5-bromo-2-methylphenyl)-3-iodobenzamide
CID 43806317

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide (CID 43806322) is 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide is Cc1ccc(Br)cc1NC(=O)c1cncc(Br)c1.
What is the InChIKey of 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is HTSZMAKPTQLEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Br2N2O/c1-8-2-3-10(14)5-12(8)17-13(18)9-4-11(15)7-16-6-9/h2-7H,1H3,(H,17,18).
What are the key properties of 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide?
5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 370.04 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(5-bromo-2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 43806322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).