Basic information
- Standard SMILES
N#CC(CCc1ccccc1)NC(=O)OCc1ccccc1- InChIKey
WYZZDWMMHHULDS-UHFFFAOYSA-N- Molecular formula
- C18H18N2O2
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.13682782
Names & identifiers
- Preferred name
- Benzyl (1-cyano-3-phenylpropyl)carbamate
- IUPAC
- benzyl N-(1-cyano-3-phenylpropyl)carbamate
Names & synonyms
WYZZDWMMHHULDS-UHFFFAOYSA-NBenzyl (1-cyano-3-phenylpropyl)carbamate
Database identifiers
- PubChem CID
- 15946346
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
2 records
Compound notes
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