TL;DR: 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol (CAS 1267612-61-2) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,5-dimethylphenyl)-2-(propan-2-ylamino)ethanol
Also Known As: 1-(2,5-dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol, 1-(2,5-dimethylphenyl)-2-(propan-2-ylamino)ethanol, 1-(2,5-DIMETHYLPHENYL)-2-(ISOPROPYLAMINO)ETHANOL
| Molecular Formula | C13H21NO |
| Molecular Weight | 207.16231 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.16231 Da |
| Heavy Atoms | 15 |
| Complexity | 181.0 |
| SMILES | CC1=CC(=C(C=C1)C)C(CNC(C)C)O |
| InChIKey | PHFWPIKQCFQPJY-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol. With a topological polar surface area (TPSA) of 32.3 Ų, 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol has 2 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 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol is 1267612-61-2.
The molecular formula of 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol is C13H21NO.
The molecular weight of 1-(2,5-Dimethylphenyl)-2-[(propan-2-yl)amino]ethan-1-ol is 207.16231 g/mol.
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