3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine
TL;DR: 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine (CAS 114121-68-5) is a chemical compound with molecular formula C20H29NO2 and molecular weight 315.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-2-[[(3R)-1-azabicyclo[2.2.2]octan-3-yl]oxy]-1-cyclopentyl-1-phenylethanol
Also Known As: 3-Pcheq, Penequine hydrochloride, Penehyclidine Impurity 9, 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine, (1R)-2-[[(3R)-1-azabicyclo[2.2.2]octan-3-yl]oxy]-1-cyclopentyl-1-phenylethanol
| Molecular Formula | C20H29NO2 |
|---|---|
| Molecular Weight | 315.22 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.21982 |
| Heavy Atoms | 23 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 114121-68-5 |
|---|---|
| SMILES | C1CCC(C1)[C@](CO[C@H]2CN3CCC2CC3)(C4=CC=CC=C4)O |
| InChIKey | GTKRIWMDLNOSLI-PMACEKPBSA-N |
Product Overview
3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine (CAS 114121-68-5), with molecular formula C20H29NO2 and molecular weight 315.22 g/mol. IUPAC: (1R)-2-[[(3R)-1-azabicyclo[2.2.2]octan-3-yl]oxy]-1-cyclopentyl-1-phenylethanol.
Chemical Property Profile of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine
Property Insights of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine
The XLogP value of 3.2 indicates that 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine has 1 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 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine?
The CAS number of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine is 114121-68-5.
What is the molecular formula of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine?
The molecular formula of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine is C20H29NO2.
What is the molecular weight of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine?
The molecular weight of 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine is 315.22 g/mol.
Where can I buy 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine?
You can request a quote for 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.