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Basic information
- Standard SMILES
COc1ccc(O[C@@H](CC(C)C)[C@H]2CCNC2)c(C)n1- InChIKey
SNNRWIBSGBMYRF-ZFWWWQNUSA-N- Molecular formula
- C16H26N2O2
- Average molar mass
- 278.39 g/mol
Names & identifiers
- Preferred name
- (S)-3-((S)-1-(6-methoxy-2-methyl-3-pyridyloxy)-3-methylbutyl)-pyrrolidine
- IUPAC
- 6-methoxy-2-methyl-3-[(1S)-3-methyl-1-[(3S)-pyrrolidin-3-yl]butoxy]pyridine
Names & synonyms
CHEMBL2386162SCHEMBL585821SNNRWIBSGBMYRF-ZFWWWQNUSA-NBDBM50434279(S)-3-((S)-1-(6-methoxy-2-methyl-3-pyridyloxy)-3-methylbutyl)-pyrrolidine
Database identifiers
- PubChem CID
- 59536635
- ChEMBL
CHEMBL2386162
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 286
Related reactions
1 records
Compound notes
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