N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide
TL;DR: N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide (CAS 540518-14-7) is a chemical compound with molecular formula C20H24F3NO2 and molecular weight 367.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide
Also Known As: AO-080/42479894, N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide, N-[2-ethoxy-5-(trifluoromethyl)phenyl]-1-adamantanecarboxamide, N-[2-ethoxy-5-(trifluoromethyl)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C20H24F3NO2 |
|---|---|
| Molecular Weight | 367.18 g/mol |
| LogP | 5.259 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.1759 |
| Heavy Atoms | 26 |
| Complexity | 678.2139 |
Chemical Identifiers
| CAS Number | 540518-14-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide (CAS 540518-14-7), with molecular formula C20H24F3NO2 and molecular weight 367.18 g/mol. IUPAC: N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide.
Chemical Property Profile of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide
Property Insights of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide
The XLogP value of 5.259 indicates that N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide?
The CAS number of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide is 540518-14-7.
What is the molecular formula of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide?
The molecular formula of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide is C20H24F3NO2.
What is the molecular weight of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide?
The molecular weight of N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide is 367.18 g/mol.
Where can I buy N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide?
You can request a quote for N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-ethoxy-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.