Basic information
- Standard SMILES
CC(C)n1cnc(CC#N)c1- InChIKey
GOMOQDOGCLWXCU-UHFFFAOYSA-N- Molecular formula
- C8H11N3
- Average molar mass
- 149.19 g/mol
Names & identifiers
- Preferred name
- 4-Cyanomethyl-1-(2-propyl)imidazole
- IUPAC
- 2-(1-propan-2-ylimidazol-4-yl)acetonitrile
Names & synonyms
SCHEMBL9097889GOMOQDOGCLWXCU-UHFFFAOYSA-N4-cyanomethyl-1-(2-propyl)imidazole
Database identifiers
- PubChem CID
- 20745935
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 167
Related reactions
2 records
Compound notes
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