2-Amino-5-(2-methylphenyl)-4H-imidazol-4-one
Basic information
- CAS
112941-22-7- Standard SMILES
Cc1ccccc1C1=NC(N)=NC1=O- InChIKey
SOOCHXZWXXVVTK-UHFFFAOYSA-N- Molecular formula
- C10H9N3O
- Average molar mass
- 187.2 g/mol
- Monoisotopic mass
- 187.07456192
Names & identifiers
- Preferred name
- 2-Amino-5-(2-methylphenyl)-4H-imidazol-4-one
- IUPAC
- 2-amino-5-(2-methylphenyl)imidazol-4-one
Names & synonyms
112941-22-72-Amino-5-(2-methylphenyl)-4H-imidazol-4-oneDTXSID60603051
Database identifiers
- CAS
112941-22-7- PubChem CID
- 20156944
- DTXSID
DTXSID60603051
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 319
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Compound notes
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