Basic information
- Standard SMILES
O=C(Nc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-]- InChIKey
QXWYDYPKQDCXMY-UHFFFAOYSA-N- Molecular formula
- C12H8ClN3O3
- Average molar mass
- 277.66 g/mol
- Monoisotopic mass
- 277.0254188
Names & identifiers
- Preferred name
- N-(5-chloropyridin-2-yl)-2-nitrobenzamide
- IUPAC
- N-(5-chloro-2-pyridinyl)-2-nitrobenzamide
Names & synonyms
N-(5-chloropyridin-2-yl)-2-nitrobenzamide280771-60-0Oprea1_714334Oprea1_792952MLS000710981SCHEMBL2438920CHEMBL1418638QXWYDYPKQDCXMY-UHFFFAOYSA-NHMS2656F23STK175582AKOS000595831SMR000280748
Show more names
DB-109647N-(5-chloropyridin-2-yl)-2-nitro-benzamideST50720984SR-01000396294N-(5-chloro(2-pyridyl))(2-nitrophenyl)carboxamideSR-01000396294-1Z59255575
Database identifiers
- PubChem CID
- 766647
- ChEMBL
CHEMBL1418638
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
15 records
Compound notes
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