![ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate structure](/static/products/116/1164468-31-8.webp)
ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate
TL;DR: ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate (CAS 1164468-31-8) is a chemical compound with molecular formula C17H20N2O5 and molecular weight 332.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate
Also Known As: ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate, ethyl 1-[3-(2-nitrophenyl)acryloyl]-3-piperidinecarboxylate, (E)-ethyl 1-(3-(2-nitrophenyl)acryloyl)piperidine-3-carboxylate, ethyl 1-[(E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate
Technical Specifications
| Molecular Formula | C17H20N2O5 |
| Molecular Weight | 332.1372 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.1372 Da |
| Heavy Atoms | 24 |
| Complexity | 500.0 |
| SMILES | CCOC(=O)C1CCCN(C1)C(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | XRGRYVGJDVRJPA-MDZDMXLPSA-N |
Chemical Property Profile of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate
Property Insights of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate. Following Lipinski's Rule of Five, ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate?
The CAS number of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate is 1164468-31-8.
What is the molecular formula of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate?
The molecular formula of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate is C17H20N2O5.
What is the molecular weight of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate?
The molecular weight of ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate is 332.1372 g/mol.
Where can I buy ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate?
You can request a quote for ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl 1-[(2E)-3-(2-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.