N-Ethyl-3-piperidyl phenylcyclopentylglycolate
TL;DR: N-Ethyl-3-piperidyl phenylcyclopentylglycolate (CAS 467-68-5) is a chemical compound with molecular formula C20H29NO3 and molecular weight 331.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpiperidin-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate
Also Known As: Ditran, N-Ethyl-3-piperidyl phenylcyclopentylglycolate, 1-ethylpiperidin-3-yl cyclopentyl(hydroxy)phenylacetate, 1-Ethyl-3-piperidyl-alpha-cyclopentyl mandelate, N-Ethyl-3-piperidyl alpha-phenyl-alpha-cyclopentylglycolate
| Molecular Formula | C20H29NO3 |
|---|---|
| Molecular Weight | 331.21 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.21475 |
| Heavy Atoms | 24 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 467-68-5 |
|---|---|
| SMILES | CCN1CCCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O |
| InChIKey | OAWRXBDGRIPUMA-UHFFFAOYSA-N |
Product Overview
N-Ethyl-3-piperidyl phenylcyclopentylglycolate (CAS 467-68-5), with molecular formula C20H29NO3 and molecular weight 331.21 g/mol. IUPAC: (1-ethylpiperidin-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate.
Chemical Property Profile of N-Ethyl-3-piperidyl phenylcyclopentylglycolate
Property Insights of N-Ethyl-3-piperidyl phenylcyclopentylglycolate
The XLogP value of 3.8 indicates that N-Ethyl-3-piperidyl phenylcyclopentylglycolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, N-Ethyl-3-piperidyl phenylcyclopentylglycolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Ethyl-3-piperidyl phenylcyclopentylglycolate 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 N-Ethyl-3-piperidyl phenylcyclopentylglycolate?
The CAS number of N-Ethyl-3-piperidyl phenylcyclopentylglycolate is 467-68-5.
What is the molecular formula of N-Ethyl-3-piperidyl phenylcyclopentylglycolate?
The molecular formula of N-Ethyl-3-piperidyl phenylcyclopentylglycolate is C20H29NO3.
What is the molecular weight of N-Ethyl-3-piperidyl phenylcyclopentylglycolate?
The molecular weight of N-Ethyl-3-piperidyl phenylcyclopentylglycolate is 331.21 g/mol.
Where can I buy N-Ethyl-3-piperidyl phenylcyclopentylglycolate?
You can request a quote for N-Ethyl-3-piperidyl phenylcyclopentylglycolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ethyl-3-piperidyl phenylcyclopentylglycolate?
Yes, KEHONG BIO provides custom synthesis services for N-Ethyl-3-piperidyl phenylcyclopentylglycolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.