TL;DR: Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium (CAS 771411-66-6) is a chemical compound with molecular formula C13H21N2O2+ and molecular weight 237.16031 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium
Also Known As: ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium, N-Ethyl-N,N,4-trimethyl-3-[[(methylamino)carbonyl]oxy]benzenaminium, Benzenaminium, N-ethyl-N,N,4-trimethyl-3-[[(methylamino)carbonyl]oxy]-
| Molecular Formula | C13H21N2O2+ |
| Molecular Weight | 237.16031 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.16031 Da |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
| SMILES | CC[N+](C)(C)C1=CC(=C(C=C1)C)OC(=O)NC |
| InChIKey | NLOGEROOBYNEFV-UHFFFAOYSA-O |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium has 1 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 Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium is 771411-66-6.
The molecular formula of Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium is C13H21N2O2+.
The molecular weight of Ethyl-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium is 237.16031 g/mol.
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