Basic information
- Standard SMILES
CC(=O)OCc1nc(C(C)C)cn1Cc1ccncc1- InChIKey
AIUQYKLWWBZSOR-UHFFFAOYSA-N- Molecular formula
- C15H19N3O2
- Average molar mass
- 273.33 g/mol
- Monoisotopic mass
- 273.14772686
Names & identifiers
- Preferred name
- 2-Acetyloxymethyl-4-isopropyl-1-(pyridin-4-yl)methyl-1H-imidazole
- IUPAC
- [4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl acetate
Names & synonyms
SCHEMBL5853054AIUQYKLWWBZSOR-UHFFFAOYSA-N2-Acetyloxymethyl-4-isopropyl-1-(pyridin-4-yl)methyl-1H-imidazole
Database identifiers
- PubChem CID
- 15458331
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Related reactions
2 records
Compound notes
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