1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide
TL;DR: 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide (CAS 54099-14-8) is a chemical compound with molecular formula C20H37IN2O and molecular weight 448.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-[2-(diethylamino)ethyl]acetamide;iodoethane
Also Known As: N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide, 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide, 2-(1-adamantyl)-N-(2-diethylaminoethyl)acetamide, Ethanaminium, N,N,N-triethyl-2-((tricyclo(3.3.1.1(sup 3,7))dec-1-ylacetyl)amino)-, iodide, 2-(1-adamantyl)-N-(2-diethylaminoethyl)acetamide; iodoethane
| Molecular Formula | C20H37IN2O |
|---|---|
| Molecular Weight | 448.20 g/mol |
| LogP | 4.49 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 448.19507 |
| Heavy Atoms | 24 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 54099-14-8 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)CC12CC3CC(C1)CC(C3)C2.CCI |
| InChIKey | LXGRGWRJGHQXFJ-UHFFFAOYSA-N |
Product Overview
1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide (CAS 54099-14-8), with molecular formula C20H37IN2O and molecular weight 448.20 g/mol. IUPAC: 2-(1-adamantyl)-N-[2-(diethylamino)ethyl]acetamide;iodoethane.
Chemical Property Profile of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide
Property Insights of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide
The XLogP value of 4.49 indicates that 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide 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 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide?
The CAS number of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide is 54099-14-8.
What is the molecular formula of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide?
The molecular formula of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide is C20H37IN2O.
What is the molecular weight of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide?
The molecular weight of 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide is 448.20 g/mol.
Where can I buy 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide?
You can request a quote for 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.