(S)-N-(1-(2-phenylethyl)pyrrolidin-3-yl)-1-adamantanecarboxamide
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Basic information
- Standard SMILES
O=C(N[C@H]1CCN(CCc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2- InChIKey
DIYWXMAFIJZOJZ-YYCBCANDSA-N- Molecular formula
- C23H32N2O
- Average molar mass
- 352.5 g/mol
Names & identifiers
- Preferred name
- (S)-N-(1-(2-phenylethyl)pyrrolidin-3-yl)-1-adamantanecarboxamide
- IUPAC
- N-[(3S)-1-(2-phenylethyl)pyrrolidin-3-yl]adamantane-1-carboxamide
Names & synonyms
CHEMBL315259SCHEMBL7729574DIYWXMAFIJZOJZ-YYCBCANDSA-NBDBM50218396(S)-N-(1-(2-phenylethyl)pyrrolidin-3-yl)-1-adamantanecarboxamide
Database identifiers
- PubChem CID
- 9841449
- ChEMBL
CHEMBL315259- Nikkaji
- J1.427.260G
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 483
Related reactions
1 records
Compound notes
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