N-(Aminocarbonyl)-2-ethyl-2-butenamide
TL;DR: N-(Aminocarbonyl)-2-ethyl-2-butenamide (CAS 5982-97-8) is a chemical compound with molecular formula C7H12N2O2 and molecular weight 156.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-carbamoyl-2-ethylbut-2-enamide
Also Known As: Ectylurea, Ectylcarbamide, (2-Ethylcrotonoyl)urea, 1-(2-Ethylcrotonoyl)urea, cis-2-ETHYLCROTONYLUREA
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H12N2O2 |
| Molecular Weight | 156.08987 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.08987 Da |
| Heavy Atoms | 11 |
| Complexity | 197.0 |
| SMILES | CCC(=CC)C(=O)NC(=O)N |
| InChIKey | QCUPYFTWJOZAOB-UHFFFAOYSA-N |
Product Description
Applications: N-(Aminocarbonyl)-2-ethyl-2-butenamide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
N-(Aminocarbonyl)-2-ethyl-2-butenamide is a pharmaceutical intermediate identified by CAS number 5982-97-8 and the molecular formula C7H12N2O2 and a molecular weight of 156.09 g/mol. Synonyms include Ectylurea and Ectylcarbamide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(Aminocarbonyl)-2-ethyl-2-butenamide
Property Insights of N-(Aminocarbonyl)-2-ethyl-2-butenamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Aminocarbonyl)-2-ethyl-2-butenamide. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(Aminocarbonyl)-2-ethyl-2-butenamide. Following Lipinski's Rule of Five, N-(Aminocarbonyl)-2-ethyl-2-butenamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(Aminocarbonyl)-2-ethyl-2-butenamide?
The CAS number of N-(Aminocarbonyl)-2-ethyl-2-butenamide is 5982-97-8.
What is the molecular formula of N-(Aminocarbonyl)-2-ethyl-2-butenamide?
The molecular formula of N-(Aminocarbonyl)-2-ethyl-2-butenamide is C7H12N2O2.
What is the molecular weight of N-(Aminocarbonyl)-2-ethyl-2-butenamide?
The molecular weight of N-(Aminocarbonyl)-2-ethyl-2-butenamide is 156.08987 g/mol.
What are the applications of N-(Aminocarbonyl)-2-ethyl-2-butenamide?
N-(Aminocarbonyl)-2-ethyl-2-butenamide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy N-(Aminocarbonyl)-2-ethyl-2-butenamide?
You can request a quote for N-(Aminocarbonyl)-2-ethyl-2-butenamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(Aminocarbonyl)-2-ethyl-2-butenamide?
Yes, CoreyChem provides custom synthesis services for N-(Aminocarbonyl)-2-ethyl-2-butenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.