1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide
TL;DR: 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide (CAS 54099-13-7) is a chemical compound with molecular formula C18H33IN2O and molecular weight 420.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-[2-(dimethylamino)ethyl]acetamide;iodoethane
Also Known As: N-(2-(Dimethylamino)ethyl)-1-adamantaneacetamide ethyl iodide, 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide, 1-Adamantaneacetamide,N-(2-(dimethylamino)ethyl)-,ethyl iodide, 2-(1-adamantyl)-N-(2-dimethylaminoethyl)acetamide; iodoethane, 2-(1-adamantyl)-N-[2-(dimethylamino)ethyl]acetamide,iodoethane
| Molecular Formula | C18H33IN2O |
|---|---|
| Molecular Weight | 420.16 g/mol |
| LogP | 3.71 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.16376 |
| Heavy Atoms | 22 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 54099-13-7 |
|---|---|
| SMILES | CCI.CN(C)CCNC(=O)CC12CC3CC(C1)CC(C3)C2 |
| InChIKey | PGOKHCGKMLHFFS-UHFFFAOYSA-N |
Product Overview
1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide (CAS 54099-13-7), with molecular formula C18H33IN2O and molecular weight 420.16 g/mol. IUPAC: 2-(1-adamantyl)-N-[2-(dimethylamino)ethyl]acetamide;iodoethane.
Chemical Property Profile of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide
Property Insights of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide
The XLogP value of 3.71 indicates that 1-Adamantaneacetamide, N-(2-(dimethylamino)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-(dimethylamino)ethyl)-, ethyl iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantaneacetamide, N-(2-(dimethylamino)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-(dimethylamino)ethyl)-, ethyl iodide?
The CAS number of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide is 54099-13-7.
What is the molecular formula of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide?
The molecular formula of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide is C18H33IN2O.
What is the molecular weight of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide?
The molecular weight of 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide is 420.16 g/mol.
Where can I buy 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide?
You can request a quote for 1-Adamantaneacetamide, N-(2-(dimethylamino)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-(dimethylamino)ethyl)-, ethyl iodide?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantaneacetamide, N-(2-(dimethylamino)ethyl)-, ethyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.