Basic information
- CAS
89181-88-4- Standard SMILES
CNc1c([N+](=O)[O-])ncn1C- InChIKey
INOKTQSWYWYYFI-UHFFFAOYSA-N- Molecular formula
- C5H8N4O2
- Average molar mass
- 156.14 g/mol
- Monoisotopic mass
- 156.06472551
Names & identifiers
- Preferred name
- n,1-Dimethyl-4-nitro-1h-imidazol-5-amine
- IUPAC
- N,3-dimethyl-5-nitroimidazol-4-amine
Names & synonyms
n,1-dimethyl-4-nitro-1h-imidazol-5-amine89181-88-4NSC154821Oprea1_555523MLS000554653CHEMBL1453249DTXSID40302878HMS2311F04STK530010AKOS005463233NSC-154821SMR000146770
Show more names
Methyl-(3-methyl-5-nitro-3H-imidazol-4-yl)-amine
Database identifiers
- CAS
89181-88-4- PubChem CID
- 290685
- DTXSID
DTXSID40302878- ChEMBL
CHEMBL1453249
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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