TL;DR: RefChem:282284 (CAS 126947-73-7) is a chemical compound with molecular formula C19H24N2O3 and molecular weight 328.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-(adamantane-1-carbonylamino)pyridine-3-carboxylate
Also Known As: ethyl 5-(adamant-1-oylamino)nicotinate, 5-(Adamant-1-ylamino)nicotinic acid ethyl ester, ethyl 5-(1-adamantylamino)pyridine-3-carboxylate, 3-Pyridinecarboxylic acid, 5-((tricyclo(3.3.1.1(sup 3,7))dec-1-ylcarbonyl)amino)-, ethyl ester, ethyl 5-(adamantane-1-carbonylamino)pyridine-3-carboxylate
| Molecular Formula | C19H24N2O3 |
| Molecular Weight | 328.17868 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.17868 Da |
| Heavy Atoms | 24 |
| Complexity | 477.0 |
| SMILES | CCOC(=O)C1=CC(=CN=C1)NC(=O)C23CC4CC(C2)CC(C4)C3 |
| InChIKey | XAPROWNTGUUMIR-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:282284. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:282284. Following Lipinski's Rule of Five, RefChem:282284 has 1 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 RefChem:282284 is 126947-73-7.
The molecular formula of RefChem:282284 is C19H24N2O3.
The molecular weight of RefChem:282284 is 328.17868 g/mol.
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