TL;DR: 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol (CAS 103394-27-0) is a chemical compound with molecular formula C10H16N2O and molecular weight 180.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-aminophenyl)-2-(dimethylamino)ethanol
Also Known As: alpha-(m-Aminophenyl)-beta-dimethylaminoethanol, 1-(3-aminophenyl)-2-(dimethylamino)ethanol, m-Amino-alpha-((dimethylamino)methyl)benzyl alcohol, 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol, BENZYL ALCOHOL, m-AMINO-alpha-((DIMETHYLAMINO)METHYL)-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H16N2O |
| Molecular Weight | 180.12627 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 49.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.12627 Da |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
| SMILES | CN(C)CC(C1=CC(=CC=C1)N)O |
| InChIKey | JOOROKMKCAHFNR-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol. With a topological polar surface area (TPSA) of 49.5 Ų, 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol is 103394-27-0.
The molecular formula of 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol is C10H16N2O.
The molecular weight of 1-(3-Aminophenyl)-2-(dimethylamino)ethan-1-ol is 180.12627 g/mol.
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