(2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester
TL;DR: (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester (CAS 110998-14-6) is a chemical compound with molecular formula C16H25NO5 and molecular weight 311.17328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl (Z)-2-(2,2,5-trimethyl-4-oxopiperidin-1-yl)but-2-enedioate
Also Known As: (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester, 2-Butenedioic acid, 2-(2,2,5-trimethyl-4-oxo-1-piperidinyl)-, diethyl ester, (E)-, (E)-2-(2,2,5-Trimethyl-4-oxo-1-piperidinyl)-2-butenedioic acid diethyl ester, diethyl (Z)-2-(2,2,5-trimethyl-4-oxopiperidin-1-yl)but-2-enedioate, BRN 5591642
Technical Specifications
| Molecular Formula | C16H25NO5 |
| Molecular Weight | 311.17328 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.17328 Da |
| Heavy Atoms | 22 |
| Complexity | 481.0 |
| SMILES | CCOC(=O)/C=C(/C(=O)OCC)\N1CC(C(=O)CC1(C)C)C |
| InChIKey | WGCVXHHYFUDLIP-WQLSENKSSA-N |
Chemical Property Profile of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester
Property Insights of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester. Following Lipinski's Rule of Five, (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester?
The CAS number of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester is 110998-14-6.
What is the molecular formula of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester?
The molecular formula of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester is C16H25NO5.
What is the molecular weight of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester?
The molecular weight of (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester is 311.17328 g/mol.
Where can I buy (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester?
You can request a quote for (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester?
Yes, CoreyChem provides custom synthesis services for (2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.