Basic information
- CAS
845959-69-5- Standard SMILES
O[C@H]1CCCCC1N1CC[C@@H](OCc2ccccc2)C1- InChIKey
KOZXDMVFYPKCCY-SKQWJGTPSA-N- Molecular formula
- C17H25NO2
- Average molar mass
- 275.4 g/mol
- Monoisotopic mass
- 275.18852904
Names & identifiers
- Preferred name
- (1S)-2-[(3R)-3-(Phenylmethoxy)-1-pyrrolidinyl]cyclohexanol
- IUPAC
- (1S)-2-[(3R)-3-phenylmethoxypyrrolidin-1-yl]cyclohexan-1-ol
Names & synonyms
SCHEMBL12122782(1S)-2-[(3R)-3-(Phenylmethoxy)-1-pyrrolidinyl]cyclohexanolDTXSID501192982845959-69-5(1S)-2-[(3R)-3-(Benzyloxy)pyrrolidin-1-yl]cyclohexan-1-ol
Database identifiers
- CAS
845959-69-5- PubChem CID
- 11637652
- DTXSID
DTXSID501192982
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 291
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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