(8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) 2-Hydroxy-2-Phenylacetate
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1237117 | |
| PubChem: | 3623 | |
| IUPAC: | (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate | |
| Standard InChI: | InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3 | |
| Standard InChI Key: | ZTVIKZXZYLEVOL-UHFFFAOYSA-N | |
| SMILES: | OC(c1ccccc1)C(=O)OC1CC2CCC(C1)N2C | |
Molecular propeties
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| AlogP: | 1.89 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 3 | |
| Molecular Weight: | 275.15 | |
| Topological polar surface area: | 49.8 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.562 | |
| Number of carbons: | 16 | |