2-Cyano-3-(4-morpholinyl)-2-propenamide
TL;DR: 2-Cyano-3-(4-morpholinyl)-2-propenamide (CAS 25229-97-4) is a chemical compound with molecular formula C8H11N3O2 and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3-morpholin-4-ylprop-2-enamide
Also Known As: 2-Cyano-3-morpholinoacrylamide, Abacavir Impurity 17, 3-Morpholino-2-cyanoacrylamide, 2-cyano-3-morpholin-4-ylprop-2-enamide, (E)-2-cyano-3-morpholinoacrylamide
| Molecular Formula | C8H11N3O2 |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 79.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.08513 |
| Heavy Atoms | 13 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 25229-97-4 |
|---|---|
| SMILES | C1COCCN1C=C(C#N)C(=O)N |
| InChIKey | LLKCXVWITGBXLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyano-3-(4-morpholinyl)-2-propenamide (CAS 25229-97-4), with molecular formula C8H11N3O2 and molecular weight 181.09 g/mol. IUPAC: 2-cyano-3-morpholin-4-ylprop-2-enamide.
Chemical Property Profile of 2-Cyano-3-(4-morpholinyl)-2-propenamide
Property Insights of 2-Cyano-3-(4-morpholinyl)-2-propenamide
The XLogP value of -0.9 indicates that 2-Cyano-3-(4-morpholinyl)-2-propenamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(4-morpholinyl)-2-propenamide. Following Lipinski's Rule of Five, 2-Cyano-3-(4-morpholinyl)-2-propenamide 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 2-Cyano-3-(4-morpholinyl)-2-propenamide?
The CAS number of 2-Cyano-3-(4-morpholinyl)-2-propenamide is 25229-97-4.
What is the molecular formula of 2-Cyano-3-(4-morpholinyl)-2-propenamide?
The molecular formula of 2-Cyano-3-(4-morpholinyl)-2-propenamide is C8H11N3O2.
What is the molecular weight of 2-Cyano-3-(4-morpholinyl)-2-propenamide?
The molecular weight of 2-Cyano-3-(4-morpholinyl)-2-propenamide is 181.09 g/mol.
Where can I buy 2-Cyano-3-(4-morpholinyl)-2-propenamide?
You can request a quote for 2-Cyano-3-(4-morpholinyl)-2-propenamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-3-(4-morpholinyl)-2-propenamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-(4-morpholinyl)-2-propenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.