Basic information
- Standard SMILES
Cn1cncc1C(=O)C1CCOCC1- InChIKey
QGGQRJVBECSYDH-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- (1-Methyl-1H-imidazol-5-yl)(tetrahydro-2H-pyran-4-yl)methanone
- IUPAC
- (3-methylimidazol-4-yl)-(oxan-4-yl)methanone
Names & synonyms
(1-Methyl-1H-imidazol-5-yl)(tetrahydro-2H-pyran-4-yl)methanoneSCHEMBL16633167QGGQRJVBECSYDH-UHFFFAOYSA-NAKOS021214309DB-4058451556254-43-3
Database identifiers
- PubChem CID
- 82895191
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Related reactions
2 records
Compound notes
Loading…