Basic information
- Standard SMILES
O=C(NCCCCCCO)OC1CCN(C(=O)OCc2ccccc2)CC1- InChIKey
MMDCNVSKIBNUBJ-UHFFFAOYSA-N- Molecular formula
- C20H30N2O5
- Average molar mass
- 378.5 g/mol
- Monoisotopic mass
- 378.21547206
Names & identifiers
- Preferred name
- 4-(6-Hydroxy-hexylcarbamoyloxy)-piperidine-1-carboxylic acid benzyl ester
- IUPAC
- benzyl 4-(6-hydroxyhexylcarbamoyloxy)piperidine-1-carboxylate
Names & synonyms
SCHEMBL8487227MMDCNVSKIBNUBJ-UHFFFAOYSA-N4-(6-Hydroxy-hexylcarbamoyloxy)-piperidine-1-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 54079568
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 432
Related reactions
4 records
Compound notes
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