Basic information
- Standard SMILES
O=C(Nc1ccc(Br)cn1)c1ccccc1[N+](=O)[O-]- InChIKey
LEGHUVFDTOMOAD-UHFFFAOYSA-N- Molecular formula
- C12H8BrN3O3
- Average molar mass
- 322.11 g/mol
- Monoisotopic mass
- 320.9749
Names & identifiers
- Preferred name
- N-(5-bromopyridin-2-yl)-2-nitrobenzamide
- IUPAC
- N-(5-bromo-2-pyridinyl)-2-nitrobenzamide
Names & synonyms
N-(5-bromopyridin-2-yl)-2-nitrobenzamideOprea1_406928SCHEMBL890832LEGHUVFDTOMOAD-UHFFFAOYSA-NAKOS001583437ST020696DB-109643N-(5-bromo(2-pyridyl))(2-nitrophenyl)carboxamideSR-01000396291n-(5-bromo-2-pyridinyl)-(2-nitro)phenylcarboxamideSR-01000396291-1313226-84-5
Database identifiers
- PubChem CID
- 679218
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 348
Related reactions
6 records
Compound notes
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