TL;DR: 1-Methylpiperidin-4-yl methanesulfonate (CAS 127423-65-8) is a chemical compound with molecular formula C7H15NO3S and molecular weight 193.07727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-4-yl) methanesulfonate
Also Known As: 1-methylpiperidin-4-yl methanesulfonate, 4-Methanesulfonyloxy-1-methylpiperidine, 1-methyl-4-methylsulfonyloxy-piperidine, 1-methylpiperidin-4-yl methanesulphonate, (1-methylpiperidin-4-yl) methanesulfonate
| Molecular Formula | C7H15NO3S |
| Molecular Weight | 193.07727 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.07727 Da |
| Heavy Atoms | 12 |
| Complexity | 224.0 |
| SMILES | CN1CCC(CC1)OS(=O)(=O)C |
| InChIKey | AGCFCASEZOEYBD-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylpiperidin-4-yl methanesulfonate. With a topological polar surface area (TPSA) of 55.0 Ų, 1-Methylpiperidin-4-yl methanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpiperidin-4-yl methanesulfonate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Methylpiperidin-4-yl methanesulfonate is 127423-65-8.
The molecular formula of 1-Methylpiperidin-4-yl methanesulfonate is C7H15NO3S.
The molecular weight of 1-Methylpiperidin-4-yl methanesulfonate is 193.07727 g/mol.
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