N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride
TL;DR: N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride (CAS 2001-91-4) is a chemical compound with molecular formula C20H30ClNO3 and molecular weight 367.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpyrrolidin-2-yl)methyl 2-cyclopentyl-2-hydroxy-2-phenylacetate;hydrochloride
Also Known As: N-Ethyl-2-pyrrolidylmethylphenylcyclopentyl-glycollate, N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride, (1-Ethyl-2-pyrrolidinyl)methyl alpha-cyclopentyl-alpha-hydroxybenzeneacetate hydrochloride, Mandelic acid, .alpha.-cyclopentyl-, (1-ethyl-2-pyrrolidinyl)methyl ester hydrochloride, N-ethyl-2 pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride
| Molecular Formula | C20H30ClNO3 |
|---|---|
| Molecular Weight | 367.19 g/mol |
| LogP | 3.51 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.1914 |
| Heavy Atoms | 25 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 2001-91-4 |
|---|---|
| SMILES | CCN1CCCC1COC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.Cl |
| InChIKey | ZYHGAQAAQHWBGF-UHFFFAOYSA-N |
Product Overview
N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride (CAS 2001-91-4), with molecular formula C20H30ClNO3 and molecular weight 367.19 g/mol. IUPAC: (1-ethylpyrrolidin-2-yl)methyl 2-cyclopentyl-2-hydroxy-2-phenylacetate;hydrochloride.
Chemical Property Profile of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride
Property Insights of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride
The XLogP value of 3.51 indicates that N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride 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-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride has 2 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-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride?
The CAS number of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride is 2001-91-4.
What is the molecular formula of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride?
The molecular formula of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride is C20H30ClNO3.
What is the molecular weight of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride?
The molecular weight of N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride is 367.19 g/mol.
Where can I buy N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride?
You can request a quote for N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-Ethyl-2-pyrrolidylmethyl phenylcyclopentylglycolate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.