TL;DR: N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine (CAS 121252-55-9) is a chemical compound with molecular formula C13H17N5 and molecular weight 243.14839 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine
Also Known As: N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine, N-6-(ENDO-2-NORBORNYL)-9-METHYLADENINE,DL-, n-(bicyclo[2.2.1]hept-1-yl)-9-methyl-9h-purin-6-amine, N-(Bicyclo[2.2.1]heptan-1-yl)-9-methyl-9H-purin-6-amine
| Molecular Formula | C13H17N5 |
| Molecular Weight | 243.14839 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.14839 Da |
| Heavy Atoms | 18 |
| Complexity | 325.0 |
| SMILES | CN1C=NC2=C(N=CN=C21)NC34CCC(C3)CC4 |
| InChIKey | NCQNNYOJKKOGAY-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine. With a topological polar surface area (TPSA) of 55.6 Ų, N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine 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 N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine is 121252-55-9.
The molecular formula of N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine is C13H17N5.
The molecular weight of N-(4-bicyclo[2.2.1]heptanyl)-9-methylpurin-6-amine is 243.14839 g/mol.
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