TL;DR: 2-(Adamantan-1-yl)-2-aminoethan-1-ol (CAS 111749-17-8) is a chemical compound with molecular formula C12H21NO and molecular weight 195.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-adamantyl)-2-aminoethanol
Also Known As: rac-2-(1-adamantyl)-2-aminoethanol, 2-(1-adamantyl)-2-aminoethanol, 2-(adamantan-1-yl)-2-aminoethan-1-ol, 2-(ADAMANTAN-1-YL)-2-AMINOETHANOL, 2-amino-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanol
| Molecular Formula | C12H21NO |
| Molecular Weight | 195.16231 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.16231 Da |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)C(CO)N |
| InChIKey | HBUUJKSRVMGCEK-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Adamantan-1-yl)-2-aminoethan-1-ol. With a topological polar surface area (TPSA) of 46.3 Ų, 2-(Adamantan-1-yl)-2-aminoethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Adamantan-1-yl)-2-aminoethan-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 2-(Adamantan-1-yl)-2-aminoethan-1-ol is 111749-17-8.
The molecular formula of 2-(Adamantan-1-yl)-2-aminoethan-1-ol is C12H21NO.
The molecular weight of 2-(Adamantan-1-yl)-2-aminoethan-1-ol is 195.16231 g/mol.
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