2-bromo-N-(6-bromo-2-pyridinyl)benzamide

C12H8Br2N2O — CID 43520587

IUPAC2-bromo-N-(6-bromo-2-pyridinyl)benzamide
SMILESO=C(Nc1cccc(Br)n1)c1ccccc1Br
InChIInChI=1S/C12H8Br2N2O/c13-9-5-2-1-4-8(9)12(17)16-11-7-3-6-10(14)15-11/h1-7H,(H,15,16,17)
InChIKeyNKSWQVNAXAVQCP-UHFFFAOYSA-N
MW356.02 g/mol
LogP3.86
Rot. Bonds2

About 2-bromo-N-(6-bromo-2-pyridinyl)benzamide

2-bromo-N-(6-bromo-2-pyridinyl)benzamide (PubChem CID 43520587) has the molecular formula C12H8Br2N2O and a molecular weight of 356.02 g/mol. Its IUPAC name is 2-bromo-N-(6-bromo-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2-bromo-N-(6-bromo-2-pyridinyl)benzamide
PubChem CID43520587
Molecular FormulaC12H8Br2N2O
Molecular Weight356.02 g/mol
Exact Mass353.90
IUPAC Name2-bromo-N-(6-bromo-2-pyridinyl)benzamide
SMILESO=C(Nc1cccc(Br)n1)c1ccccc1Br
InChIInChI=1S/C12H8Br2N2O/c13-9-5-2-1-4-8(9)12(17)16-11-7-3-6-10(14)15-11/h1-7H,(H,15,16,17)
InChIKeyNKSWQVNAXAVQCP-UHFFFAOYSA-N
XLogP3.86
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.02
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,4-dibromo-N-(6-bromo-2-pyridinyl)benzamide
CID 103882532
2-bromo-N-(6-bromo-2-pyridinyl)-5-fluorobenzamide
CID 43520358
N-(6-bromo-2-pyridinyl)benzamide
CID 43520453
4-bromo-N-(6-bromo-2-pyridinyl)-2-methylbenzamide
CID 43629940
N-(6-bromo-2-pyridinyl)-2,5-difluorobenzamide
CID 43520386
N-(6-bromo-2-pyridinyl)-2,4-dimethylbenzamide
CID 43520367
4-bromo-N-(6-bromo-2-pyridinyl)-2-chlorobenzamide
CID 43805504
N-(6-bromo-2-pyridinyl)-4-hydroxybenzamide
CID 43520413
3,5-dibromo-N-(6-bromo-2-pyridinyl)benzamide
CID 114022639
4,5-dibromo-N-(6-bromo-2-pyridinyl)thiophene-2-carboxamide
CID 78971768
N-(6-bromo-2-pyridinyl)-4-fluoro-2-hydroxybenzamide
CID 103829790
N-(6-bromo-2-pyridinyl)-5-fluoro-2-methylbenzamide
CID 55134915

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(6-bromo-2-pyridinyl)benzamide?
The IUPAC name of 2-bromo-N-(6-bromo-2-pyridinyl)benzamide (CID 43520587) is 2-bromo-N-(6-bromo-2-pyridinyl)benzamide.
What is the SMILES notation for 2-bromo-N-(6-bromo-2-pyridinyl)benzamide?
The canonical SMILES for 2-bromo-N-(6-bromo-2-pyridinyl)benzamide is O=C(Nc1cccc(Br)n1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-(6-bromo-2-pyridinyl)benzamide?
The InChIKey is NKSWQVNAXAVQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br2N2O/c13-9-5-2-1-4-8(9)12(17)16-11-7-3-6-10(14)15-11/h1-7H,(H,15,16,17).
What are the key properties of 2-bromo-N-(6-bromo-2-pyridinyl)benzamide?
2-bromo-N-(6-bromo-2-pyridinyl)benzamide has a molecular weight of 356.02 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(6-bromo-2-pyridinyl)benzamide is sourced from PubChem (CID 43520587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).