1-Adamantyl-(4-methylpyrazol-1-yl)methanone
TL;DR: 1-Adamantyl-(4-methylpyrazol-1-yl)methanone (CAS 1005583-45-8) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-adamantyl-(4-methylpyrazol-1-yl)methanone
Also Known As: adamantanyl 4-methylpyrazolyl ketone, 1-adamantyl-(4-methylpyrazol-1-yl)methanone, 1-ADAMANTYL(4-METHYL-1H-PYRAZOL-1-YL)METHANONE, (4-methyl-1H-pyrazol-1-yl)(tricyclo[3.3.1.1~3,7~]dec-1-yl)methanone
Technical Specifications
| Molecular Formula | C15H20N2O |
| Molecular Weight | 244.15756 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.15756 Da |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
| SMILES | CC1=CN(N=C1)C(=O)C23CC4CC(C2)CC(C4)C3 |
| InChIKey | JTYMOAFGABYVJS-UHFFFAOYSA-N |
Chemical Property Profile of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone
Property Insights of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone
The XLogP value of 3.1 indicates that 1-Adamantyl-(4-methylpyrazol-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.9 Ų, 1-Adamantyl-(4-methylpyrazol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantyl-(4-methylpyrazol-1-yl)methanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone?
The CAS number of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone is 1005583-45-8.
What is the molecular formula of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone?
The molecular formula of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone is C15H20N2O.
What is the molecular weight of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone?
The molecular weight of 1-Adamantyl-(4-methylpyrazol-1-yl)methanone is 244.15756 g/mol.
Where can I buy 1-Adamantyl-(4-methylpyrazol-1-yl)methanone?
You can request a quote for 1-Adamantyl-(4-methylpyrazol-1-yl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Adamantyl-(4-methylpyrazol-1-yl)methanone?
Yes, CoreyChem provides custom synthesis services for 1-Adamantyl-(4-methylpyrazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.