Basic information
- Standard SMILES
O=[N+]([O-])c1cccnc1NCc1ccc(Cl)cc1- InChIKey
QJOVPRXBSUNPRO-UHFFFAOYSA-N- Molecular formula
- C12H10ClN3O2
- Average molar mass
- 263.68 g/mol
Names & identifiers
- Preferred name
- N-[(4-chlorophenyl)methyl]-3-nitropyridin-2-amine
- IUPAC
- N-[(4-chlorophenyl)methyl]-3-nitropyridin-2-amine
Names & synonyms
3723-71-5N-[(4-chlorophenyl)methyl]-3-nitropyridin-2-amineN-(4-chlorobenzyl)-3-nitro-2-pyridinamineMFCD00109004Maybridge1_001682Oprea1_672348SCHEMBL7832980HMS546E10QJOVPRXBSUNPRO-UHFFFAOYSA-NAKOS0050970776F-355SCCG-233762
Show more names
2-(4Chlorobenzyl)amino-3-nitropyridine2-(4-Chlorobenzyl)amino-3-nitropyridine2-(4-chloro-benzyl)amino-3-nitropyridine2-(4-chlorobenzyl) amino-3-nitropyridine2-(4-chlorophenylmethylamino)-3-nitropyridineN-[(4-chlorophenyl)methyl]-3-nitro-pyridin-2-amine
Database identifiers
- PubChem CID
- 2800352
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Related reactions
17 records
Compound notes
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