Basic information
- Standard SMILES
O=C1CC[C@H]2[C@H]3Cc4ccc(O)cc4[C@@]2(CCN3CC2CC2)C1- InChIKey
WGEOQAZWFGLHIA-SXLOBPIMSA-N- Molecular formula
- C20H25NO2
- Average molar mass
- 311.4 g/mol
Names & identifiers
- Preferred name
- 17-Cyclopropylmethyl-3-hydroxy-morphinan-6-one
- IUPAC
- (1S,9R,10R)-17-(cyclopropylmethyl)-4-hydroxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one
Names & synonyms
SCHEMBL11159840WGEOQAZWFGLHIA-SXLOBPIMSA-N17-cyclopropylmethyl-3-hydroxy-morphinan-6-one
Database identifiers
- PubChem CID
- 6602257
- Nikkaji
- J347.469K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 502
Related reactions
1 records
Compound notes
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