Basic information
- Standard SMILES
N#CC(c1ccccc1)(c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1- InChIKey
OGCSWAYKOXSEDZ-XMMPIXPASA-N- Molecular formula
- C25H24N2
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.19394877
Names & identifiers
- Preferred name
- ((S)-1-Benzylpyrrolidin-3-yl)diphenylacetonitrile
- IUPAC
- 2-[(3S)-1-benzylpyrrolidin-3-yl]-2,2-diphenylacetonitrile
Names & synonyms
SCHEMBL956109OGCSWAYKOXSEDZ-XMMPIXPASA-N((S)-1-Benzylpyrrolidin-3-yl)diphenylacetonitrile(S)-1-Benzyl-3-(1-cyano-1,1-diphenylmethyl)-pyrrolidine(S)-1-Benzyl-3-(1-cyano-1,1-diphenylmethyl)pyrrolidine
Database identifiers
- PubChem CID
- 13633739
- Nikkaji
- J2.233.020I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 482
Related reactions
28 records
Compound notes
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