Basic information
- Standard SMILES
C[C@@H]1CCC[C@H](C)N1CCCOc1ccc(-c2ccc(C(=O)N3CCCC3)cc2)cc1- InChIKey
FJNAJDAKGNJRSR-SZPZYZBQSA-N- Molecular formula
- C27H36N2O2
- Average molar mass
- 420.6 g/mol
Names & identifiers
- Preferred name
- (2R,6S)-2,6-dimethyl-1-(3-{[4'-(1-pyrrolidinylcarbonyl)[1,1'-biphenyl]-4-yl]oxy}propyl)piperidine
- IUPAC
- [4-[4-[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propoxy]phenyl]phenyl]-pyrrolidin-1-ylmethanone
Names & synonyms
SCHEMBL7599220FJNAJDAKGNJRSR-SZPZYZBQSA-N(2R,6S)-2,6-dimethyl-1-(3-{[4'-(1-pyrrolidinylcarbonyl)[1,1'-biphenyl]-4-yl]oxy}propyl)piperidine
Database identifiers
- PubChem CID
- 70141065
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 535
Related reactions
1 records
Compound notes
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