TL;DR: Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- (CAS 1279219-65-6) is a chemical compound with molecular formula C15H23N3 and molecular weight 245.1892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-adamantyl)-3,5-dimethylpyrazol-4-amine
Also Known As: Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl-, 1-(1-adamantyl)-3,5-dimethylpyrazol-4-amine, 1-(adamantan-1-yl)-3,5-dimethyl-1H-pyrazol-4-amine, 1-(1-Adamantyl)-3,5-dimethyl-1H-pyrazol-4-ylamine #, 3,5-dimethyl-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-4-amine
| Molecular Formula | C15H23N3 |
| Molecular Weight | 245.1892 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.1892 Da |
| Heavy Atoms | 18 |
| Complexity | 312.0 |
| SMILES | CC1=C(C(=NN1C23CC4CC(C2)CC(C4)C3)C)N |
| InChIKey | PHMVIKVPSLOUMV-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl-. With a topological polar surface area (TPSA) of 43.8 Ų, Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- has 1 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 Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- is 1279219-65-6.
The molecular formula of Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- is C15H23N3.
The molecular weight of Pyrazol-4-amine, 1-(1-adamantyl)-3,5-dimethyl- is 245.1892 g/mol.
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