Basic information
- Standard SMILES
c1ccc(CN2C[C@H](CN3CCC(c4ccccc4)CC3)[C@@H](c3ccccc3)C2)cc1- InChIKey
UBLXYTLHCHAYRI-URLMMPGGSA-N- Molecular formula
- C29H34N2
- Average molar mass
- 410.6 g/mol
Names & identifiers
- Preferred name
- 1-{[(3S,4S)-1-Benzyl-4-phenyl-3-pyrrolidinyl]methyl}-4-phenylpiperidine
- IUPAC
- 1-[[(3S,4S)-1-benzyl-4-phenylpyrrolidin-3-yl]methyl]-4-phenylpiperidine
Names & synonyms
CHEMBL90015SCHEMBL8089213UBLXYTLHCHAYRI-URLMMPGGSA-NBDBM501055291-((3S,4S)-1-Benzyl-4-phenyl-pyrrolidin-3-ylmethyl)-4-phenyl-piperidine1-{[(3S,4S)-1-Benzyl-4-phenyl-3-pyrrolidinyl]methyl}-4-phenylpiperidine(+/-)-rel-Piperidine, 4-phenyl-1-[[(3R,4S)-4-phenyl-3-pyrrolidinyl]methyl]-1-[[(3S,4S)-1-benzyl-4-phenyl-pyrrolidin-3-yl]methyl]-4-phenyl-piperidine1-Phenylmethyl-3-(S)-((4-phenylpiperidin-1-yl)methyl)-4-(S)-phenylpyrrolidine
Database identifiers
- PubChem CID
- 456374
- ChEMBL
CHEMBL90015
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 507
Related reactions
1 records
Compound notes
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