3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid
TL;DR: 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid (CAS 361374-30-3) is a chemical compound with molecular formula C12H19NO5 and molecular weight 257.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-oxo-3-(3-oxo-3-propan-2-yloxypropyl)piperidine-3-carboxylic acid
Also Known As: 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid, 3-(3-isopropoxy-3-oxopropyl)-6-oxopiperidine-3-carboxylic acid, BAS 02785754, 6-oxo-3-(3-oxo-3-propan-2-yloxypropyl)piperidine-3-carboxylic acid, 6-oxo-3-[3-oxo-3-(propan-2-yloxy)propyl]piperidine-3-carboxylic acid
| Molecular Formula | C12H19NO5 |
|---|---|
| Molecular Weight | 257.13 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 257.1263 |
| Heavy Atoms | 18 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 361374-30-3 |
|---|---|
| SMILES | CC(C)OC(=O)CCC1(CCC(=O)NC1)C(=O)O |
| InChIKey | ZJWSRDZXAUTEDM-UHFFFAOYSA-N |
Product Overview
3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid (CAS 361374-30-3), with molecular formula C12H19NO5 and molecular weight 257.13 g/mol. IUPAC: 6-oxo-3-(3-oxo-3-propan-2-yloxypropyl)piperidine-3-carboxylic acid.
Chemical Property Profile of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid
Property Insights of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid
The XLogP value of -0.1 indicates that 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid. Following Lipinski's Rule of Five, 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid has 2 hydrogen bond donor(s) and 5 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-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid?
The CAS number of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid is 361374-30-3.
What is the molecular formula of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid?
The molecular formula of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid is C12H19NO5.
What is the molecular weight of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid?
The molecular weight of 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid is 257.13 g/mol.
Where can I buy 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid?
You can request a quote for 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-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 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Isopropoxycarbonyl-ethyl)-6-oxo-piperidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.