Basic information
- Standard SMILES
CC1C(=O)NC2(C)CCC(=O)N12- InChIKey
MHLSDODDWJCESD-UHFFFAOYSA-N- Molecular formula
- C8H12N2O2
- Average molar mass
- 168.19 g/mol
- Monoisotopic mass
- 168.08987763
Names & identifiers
- Preferred name
- 3,7a-Dimethyl-1,3,6,7-tetrahydropyrrolo[1,2-a]imidazole-2,5-dione
- IUPAC
- 3,7a-dimethyl-1,3,6,7-tetrahydropyrrolo[1,2-a]imidazole-2,5-dione
Names & synonyms
CHEMBL135893SCHEMBL9599459
Database identifiers
- PubChem CID
- 10241188
- ChEMBL
CHEMBL135893
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 264
Related reactions
1 records
Compound notes
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