N-(4-Amino-3,5-dimethyl-2-nitrophenyl)acetamide
Basic information
- CAS
97629-63-5- Standard SMILES
CC(=O)Nc1cc(C)c(N)c(C)c1[N+](=O)[O-]- InChIKey
KHQRBFRUXMBDLX-UHFFFAOYSA-N- Molecular formula
- C10H13N3O3
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.09569129
Names & identifiers
- Preferred name
- N-(4-Amino-3,5-dimethyl-2-nitrophenyl)acetamide
- IUPAC
- N-(4-amino-3,5-dimethyl-2-nitrophenyl)acetamide
Names & synonyms
97629-63-5N-(4-Amino-3,5-dimethyl-2-nitrophenyl)acetamideSCHEMBL10620278DTXSID80602945
Database identifiers
- CAS
97629-63-5- PubChem CID
- 20145987
- DTXSID
DTXSID80602945
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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