Scopoline
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1394721 | |
| PubChem: | 261184 | |
| IUPAC: | 6-methyl-2-oxa-6-azatricyclo[3.3.1.03,7]nonan-4-ol | |
| Standard InChI: | InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3 | |
| Standard InChI Key: | MEGPURSNXMUDAE-UHFFFAOYSA-N | |
| SMILES: | CN1C2CC3CC1C(C2O)O3 | |
Molecular propeties
| ||
| AlogP: | -0.41 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 4 | |
| Molecular Weight: | 155.09 | |
| Topological polar surface area: | 32.7 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 1 | |
| Number of carbons: | 8 | |