TL;DR: Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride (CAS 113873-70-4) is a chemical compound with molecular formula C19H31ClN2O3 and molecular weight 370.20233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-[(dimethylamino)methyl]cyclohexyl] N-(2-propoxyphenyl)carbamate;hydrochloride
Also Known As: Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride, N-(2-Propoxyphenyl)carbamic acid 1-((dimethylamino)methyl)cyclohexyl ester hydrochloride, [1-(dimethylaminomethyl)cyclohexyl] N-(2-propoxyphenyl)carbamate hydrochloride, 1-[(Dimethylamino)methyl]cyclohexyl (2-propoxyphenyl)carbamate--hydrogen chloride (1/1), Carbamic acid, (2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, monohydrochloride
| Molecular Formula | C19H31ClN2O3 |
| Molecular Weight | 370.20233 g/mol |
| XLogP | 4.7102 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.20233 Da |
| Heavy Atoms | 25 |
| Complexity | 381.0 |
| SMILES | CCCOC1=CC=CC=C1NC(=O)OC2(CCCCC2)CN(C)C.Cl |
| InChIKey | NJFVGJXRCUEDNB-UHFFFAOYSA-N |
The XLogP value of 4.7102 indicates that Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride has 2 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 Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride is 113873-70-4.
The molecular formula of Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride is C19H31ClN2O3.
The molecular weight of Carbamic acid, N-(2-propoxyphenyl)-, 1-((dimethylamino)methyl)cyclohexyl ester, hydrochloride is 370.20233 g/mol.
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