Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate
TL;DR: Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate (CAS 414872-80-3) is a chemical compound with molecular formula C17H25NO2 and molecular weight 275.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(4-ethylphenyl)methyl]piperidine-3-carboxylate
Also Known As: ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate, AB00076948-01, Ethyl 1-[(4-ethylphenyl)methyl]piperidine-3-carboxylate
| Molecular Formula | C17H25NO2 |
|---|---|
| Molecular Weight | 275.19 g/mol |
| LogP | 3.0241 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.18854 |
| Heavy Atoms | 20 |
| Complexity | 427.12106 |
Chemical Identifiers
| CAS Number | 414872-80-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)CN2CCCC(C2)C(=O)OCC |
Product Overview
Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate (CAS 414872-80-3), with molecular formula C17H25NO2 and molecular weight 275.19 g/mol. IUPAC: ethyl 1-[(4-ethylphenyl)methyl]piperidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate
Property Insights of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate
The XLogP value of 3.0241 indicates that Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate has 0 hydrogen bond donor(s) and 3 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 1-(4-ethylbenzyl)piperidine-3-carboxylate?
The CAS number of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate is 414872-80-3.
What is the molecular formula of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate?
The molecular formula of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate is C17H25NO2.
What is the molecular weight of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate?
The molecular weight of Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate is 275.19 g/mol.
Where can I buy Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate?
You can request a quote for Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(4-ethylbenzyl)piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.