Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCCO)cc2)C(OCc2ccc3ccccc3c2)C1- InChIKey
JVZQQZBLYGMJIX-UHFFFAOYSA-N- Molecular formula
- C31H39NO5
- Average molar mass
- 505.6 g/mol
Names & identifiers
- Preferred name
- tert-butyl (3RS,4RS)-4-[4-(4-hydroxy-butoxy)-phenyl]-3-(naphthalen-2-ylmethoxy)-piperidine1-carboxylate
- IUPAC
- tert-butyl 4-[4-(4-hydroxybutoxy)phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylate
Names & synonyms
JVZQQZBLYGMJIX-UHFFFAOYSA-Ntert-butyl (3RS,4RS)-4-[4-(4-hydroxy-butoxy)-phenyl]-3-(naphthalen-2-ylmethoxy)-piperidine1-carboxylate
Database identifiers
- PubChem CID
- 53977546
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 686
Related reactions
2 records
Compound notes
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