TL;DR: Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- (CAS 1047651-75-1) is a chemical compound with molecular formula C17H30NO2+ and molecular weight 280.22766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(1-methylpiperidin-1-ium-1-yl)-9-bicyclo[3.3.1]nonanyl] acetate
Also Known As: BAS 00190167, Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl-, 1-(9-Acetoxy-bicyclo[3.3.1]non-2-yl)-1-methyl-piperidinium, [4-(1-methylpiperidin-1-ium-1-yl)-9-bicyclo[3.3.1]nonanyl] acetate, 1-[9-(Acetyloxy)bicyclo[3.3.1]nonan-2-yl]-1-methylpiperidin-1-ium
| Molecular Formula | C17H30NO2+ |
| Molecular Weight | 280.22766 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.22766 Da |
| Heavy Atoms | 20 |
| Complexity | 362.0 |
| SMILES | CC(=O)OC1C2CCCC1C(CC2)[N+]3(CCCCC3)C |
| InChIKey | KWKSYISARSAIJR-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- is 1047651-75-1.
The molecular formula of Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- is C17H30NO2+.
The molecular weight of Piperidinium, 1-[9-(acetyloxy)bicyclo[3.3.1]non-2-yl]-1-methyl- is 280.22766 g/mol.
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