TL;DR: (1S,2S)-2-(phenylamino)cyclohexan-1-ol (CAS 118457-60-6) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trans-(1S,2S)-2-anilinocyclohexan-1-ol
Also Known As: 2-anilinocyclohexan-1-ol, (1S,2S)-2-Anilinocyclohexanol, (1S,2S)-2-Anilinocyclohexanenol, 2beta-Anilinocyclohexane-1alpha-ol, (1alpha)-2beta-Anilinocyclohexanol
| Molecular Formula | C12H17NO |
| Molecular Weight | 191.13101 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.13101 Da |
| Heavy Atoms | 14 |
| Complexity | 166.0 |
| SMILES | C1CC[C@@H]([C@H](C1)NC2=CC=CC=C2)O |
| InChIKey | ABSZYEUMTNJQPI-RYUDHWBXSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,2S)-2-(phenylamino)cyclohexan-1-ol. With a topological polar surface area (TPSA) of 32.3 Ų, (1S,2S)-2-(phenylamino)cyclohexan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,2S)-2-(phenylamino)cyclohexan-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 (1S,2S)-2-(phenylamino)cyclohexan-1-ol is 118457-60-6.
The molecular formula of (1S,2S)-2-(phenylamino)cyclohexan-1-ol is C12H17NO.
The molecular weight of (1S,2S)-2-(phenylamino)cyclohexan-1-ol is 191.13101 g/mol.
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