Basic information
- Standard SMILES
C[C@H]1C(=O)NC2(C)CCC(=O)N12- InChIKey
MHLSDODDWJCESD-NTFOPCPOSA-N- Molecular formula
- C8H12N2O2
- Average molar mass
- 168.19 g/mol
Names & identifiers
- Preferred name
- (3S)-3,7a-Dimethyl-2,5-dioxohexahydro-1H-pyrrolo[1,2-a]imidazole
- IUPAC
- (3S)-3,7a-dimethyl-1,3,6,7-tetrahydropyrrolo[1,2-a]imidazole-2,5-dione
Names & synonyms
SCHEMBL9599972MHLSDODDWJCESD-NTFOPCPOSA-N(3S)-3,7a-Dimethyl-2,5-dioxohexahydro-1H-pyrrolo[1,2-a]imidazole(3S)-3,7a-Dimethyl-2,5-dioxohexahydro-1H-pyrrolo[1,2-a1imidazole(3S)-3,7a-Dimethyl-2,5-dioxohexahydro-1H-pyrrolo[1,2-a]-imidazole
Database identifiers
- PubChem CID
- 10241189
- Nikkaji
- J567.590A
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
3 records
Compound notes
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