Basic information
- Standard SMILES
O=C(OCc1ccccc1)N1C2CNCC1COC2- InChIKey
BSNVJGVVANNMNX-UHFFFAOYSA-N- Molecular formula
- C14H18N2O3
- Average molar mass
- 262.3 g/mol
Names & identifiers
- Preferred name
- 3-Oxa-7,9-diaza-bicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester
- IUPAC
- benzyl 3-oxa-7,9-diazabicyclo[3.3.1]nonane-9-carboxylate
Names & synonyms
SCHEMBL2302879BSNVJGVVANNMNX-UHFFFAOYSA-N3-Oxa-7,9-diaza-bicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 67356121
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 306
Related reactions
5 records
Compound notes
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