Basic information
- Standard SMILES
O=C(NCc1ccc2c(c1)OCO2)C1CCN(C(=O)OCc2ccccc2)CC1- InChIKey
GNZVVDNBOPDJNZ-UHFFFAOYSA-N- Molecular formula
- C22H24N2O5
- Average molar mass
- 396.4 g/mol
- Monoisotopic mass
- 396.16852187
Names & identifiers
- Preferred name
- Benzyl 4-(1,3-benzodioxol-5-ylmethylcarbamoyl)piperidine-1-carboxylate
- IUPAC
- benzyl 4-(1,3-benzodioxol-5-ylmethylcarbamoyl)piperidine-1-carboxylate
Names & synonyms
Oprea1_070418CCG-47901SR-01000637489-1
Database identifiers
- PubChem CID
- 2811287
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 557
Related reactions
83 records
Compound notes
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