1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid
TL;DR: 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 856437-22-4) is a chemical compound with molecular formula C9H16N2O3 and molecular weight 200.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid, 2-Naphthalenol, 8-bromo-, 1-(2-Dimethylamino-ethyl)-5-oxo-pyrrolidine-3-carboxylic acid, BAS 03320473, 1-(2-(dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid
| Molecular Formula | C9H16N2O3 |
|---|---|
| Molecular Weight | 200.12 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.11609 |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 856437-22-4 |
|---|---|
| SMILES | CN(C)CCN1CC(CC1=O)C(=O)O |
| InChIKey | YLZBIUIUXVYRRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 856437-22-4), with molecular formula C9H16N2O3 and molecular weight 200.12 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid
Property Insights of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid
The XLogP value of -3.3 indicates that 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid 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 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid?
The CAS number of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid is 856437-22-4.
What is the molecular formula of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular formula of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid is C9H16N2O3.
What is the molecular weight of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid?
The molecular weight of 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid is 200.12 g/mol.
Where can I buy 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid?
You can request a quote for 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(Dimethylamino)ethyl)-5-oxopyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.