TL;DR: 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride (CAS 1052512-25-0) is a chemical compound with molecular formula C13H21ClN2O3 and molecular weight 288.12408 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(dimethylamino)methyl]-4-methoxyphenyl] N,N-dimethylcarbamate;hydrochloride
Also Known As: 2-[(dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride, 2-((dimethylamino)methyl)-4-methoxyphenyl dimethylcarbamate hydrochloride, [2-(dimethylaminomethyl)-4-methoxyphenyl] N,N-dimethylcarbamate hydrochloride
| Molecular Formula | C13H21ClN2O3 |
| Molecular Weight | 288.12408 g/mol |
| XLogP | 2.239 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.12408 Da |
| Heavy Atoms | 19 |
| Complexity | 269.0 |
| SMILES | CN(C)CC1=C(C=CC(=C1)OC)OC(=O)N(C)C.Cl |
| InChIKey | NKLTWVHCFCTQFU-UHFFFAOYSA-N |
The XLogP value of 2.239 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride. With a topological polar surface area (TPSA) of 42.0 Ų, 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride has 1 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 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride is 1052512-25-0.
The molecular formula of 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride is C13H21ClN2O3.
The molecular weight of 2-[(Dimethylamino)methyl]-4-methoxyphenyl dimethylcarbamate hydrochloride is 288.12408 g/mol.
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