Basic information
- Standard SMILES
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccnc2Cl)c1- InChIKey
DQCYJCGBLZUTSO-UHFFFAOYSA-N- Molecular formula
- C13H10ClN3O3
- Average molar mass
- 291.69 g/mol
Names & identifiers
- Preferred name
- N-(2-chloropyridin-3-yl)-5-methyl-2-nitrobenzamide
- IUPAC
- N-(2-chloro-3-pyridinyl)-5-methyl-2-nitrobenzamide
Names & synonyms
N-(2-chloropyridin-3-yl)-5-methyl-2-nitrobenzamide1225-84-9N-(2-chloro-3-pyridinyl)-5-methyl-2-nitrobenzenecarboxamideMLS000755684SCHEMBL2507014CHEMBL1461727DQCYJCGBLZUTSO-UHFFFAOYSA-NHMS2587O14AKOS005107431MS-1209SMR000337346SR-01000309836
Show more names
SR-01000309836-1
Database identifiers
- PubChem CID
- 3440161
- ChEMBL
CHEMBL1461727
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
4 records
Compound notes
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