ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate
TL;DR: ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate (CAS 469890-43-5) is a chemical compound with molecular formula C20H38N2O2 and molecular weight 338.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(dimethylamino)propylamino]-2-methyl-6-pentylcyclohex-2-ene-1-carboxylate
Also Known As: ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate, Ethyl 4-(3-dimethylaminopropylamino)-2-methyl-6-pentyl-cyclohex-2-ene-1-carboxylate, ethyl 4-[3-(dimethylamino)propylamino]-2-methyl-6-pentylcyclohex-2-ene-1-carboxylate, ethyl 4-{[3-(dimethylamino)propyl]amino}-2-methyl-6-pentylcyclohex-2-ene-1-carboxylate
| Molecular Formula | C20H38N2O2 |
|---|---|
| Molecular Weight | 338.29 g/mol |
| LogP | 3.6221 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 338.29333 |
| Heavy Atoms | 24 |
| Complexity | 393.1001 |
Chemical Identifiers
| CAS Number | 469890-43-5 |
|---|---|
| SMILES | CCCCCC1CC(C=C(C1C(=O)OCC)C)NCCCN(C)C |
Product Overview
ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate (CAS 469890-43-5), with molecular formula C20H38N2O2 and molecular weight 338.29 g/mol. IUPAC: ethyl 4-[3-(dimethylamino)propylamino]-2-methyl-6-pentylcyclohex-2-ene-1-carboxylate.
Chemical Property Profile of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate
Property Insights of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate
The XLogP value of 3.6221 indicates that ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate has 1 hydrogen bond donor(s) and 4 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 ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate?
The CAS number of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate is 469890-43-5.
What is the molecular formula of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate?
The molecular formula of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate is C20H38N2O2.
What is the molecular weight of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate?
The molecular weight of ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate is 338.29 g/mol.
Where can I buy ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate?
You can request a quote for ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-((3-(dimethylamino)propyl)amino)-2-methyl-6-pentylcyclohex-2-enecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.