N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
TL;DR: N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide (CAS 515832-74-3) is a chemical compound with molecular formula C16H20F3N3O and molecular weight 327.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
Also Known As: N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide, 1H-Pyrazole-5-carboxamide, 1-methyl-N-tricyclo[3.3.1.13,7]dec-1-yl-3-(trifluoromethyl)-, N-(1-adamantyl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide, N-(Adamantan-1-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide, 1-methyl-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
| Molecular Formula | C16H20F3N3O |
|---|---|
| Molecular Weight | 327.16 g/mol |
| LogP | 3.1375 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.15585 |
| Heavy Atoms | 23 |
| Complexity | 614.2017 |
Chemical Identifiers
| CAS Number | 515832-74-3 |
|---|---|
| SMILES | CN1C(=CC(=N1)C(F)(F)F)C(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide (CAS 515832-74-3), with molecular formula C16H20F3N3O and molecular weight 327.16 g/mol. IUPAC: N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide.
Chemical Property Profile of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Property Insights of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
The XLogP value of 3.1375 indicates that N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide?
The CAS number of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide is 515832-74-3.
What is the molecular formula of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide?
The molecular formula of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide is C16H20F3N3O.
What is the molecular weight of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide?
The molecular weight of N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide is 327.16 g/mol.
Where can I buy N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide?
You can request a quote for N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-adamantyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.