Basic information
- Standard SMILES
N#CC(c1ccccc1)(c1ccccc1)C1CCN(C(=O)Oc2ccccc2)C1- InChIKey
SSDFVELUTADEDJ-UHFFFAOYSA-N- Molecular formula
- C25H22N2O2
- Average molar mass
- 382.5 g/mol
Names & identifiers
- Preferred name
- 3-(Cyanodiphenylmethyl)-1-pyrrolidinecarboxylic acid phenyl ester
- IUPAC
- phenyl 3-[cyano(diphenyl)methyl]pyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL10360083SSDFVELUTADEDJ-UHFFFAOYSA-N3-(cyanodiphenylmethyl)-1-pyrrolidinecarboxylic acid phenyl ester3-(Cyanodiphenylmethyl)-1-pyrrolidinecarboxylic acid, phenyl ester
Database identifiers
- PubChem CID
- 13633778
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 573
Related reactions
8 records
Compound notes
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