Basic information
- Standard SMILES
COc1cccc(C[C@H]2CN[C@H](C(=O)Nc3ccc(Oc4ccc(F)cc4)cc3)C2)c1- InChIKey
WBNZIEMCVPMDFF-KOSHJBKYSA-N- Molecular formula
- C25H25FN2O3
- Average molar mass
- 420.5 g/mol
- Monoisotopic mass
- 420.18492083
Names & identifiers
- Preferred name
- (2S,4R)-N-(4-(4-fluorophenoxy)phenyl)-4-(3-methoxybenzyl)pyrrolidine-2-carboxamide
- IUPAC
- (2S,4R)-N-[4-(4-fluorophenoxy)phenyl]-4-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
Names & synonyms
SCHEMBL1375674WBNZIEMCVPMDFF-KOSHJBKYSA-N(2S,4R)-N-(4-(4-fluorophenoxy)phenyl)-4-(3-methoxybenzyl)pyrrolidine-2-carboxamide
Database identifiers
- PubChem CID
- 67010644
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 561
Related reactions
3 records
Compound notes
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