TL;DR: N-Methylmeptazinol (CAS 103939-92-0) is a chemical compound with molecular formula C16H26NO+ and molecular weight 248.20145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-ethyl-1,1-dimethylazepan-1-ium-3-yl)phenol
Also Known As: N-Methylmeptazinol, 3-(3-ethyl-1,1-dimethylazepan-1-ium-3-yl)phenol, 1H-Azepinium, 3-ethylhexahydro-3-(3-hydroxyphenyl)-1,1-dimethyl-, 3-ETHYL-3-(3-HYDROXYPHENYL)-1,1-DIMETHYLAZEPAN-1-IUM
| Molecular Formula | C16H26NO+ |
| Molecular Weight | 248.20145 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.20145 Da |
| Heavy Atoms | 18 |
| Complexity | 276.0 |
| SMILES | CCC1(CCCC[N+](C1)(C)C)C2=CC(=CC=C2)O |
| InChIKey | NOLDCYJGILSJLZ-UHFFFAOYSA-O |
The XLogP value of 3.4 indicates that N-Methylmeptazinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, N-Methylmeptazinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methylmeptazinol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Methylmeptazinol is 103939-92-0.
The molecular formula of N-Methylmeptazinol is C16H26NO+.
The molecular weight of N-Methylmeptazinol is 248.20145 g/mol.
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