4-Cyanobutanamide
TL;DR: 4-Cyanobutanamide (CAS 53897-27-1) is a chemical compound with molecular formula C5H8N2O and molecular weight 112.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyanobutanamide
Also Known As: 4-cyanobutanamide, 4-Cyanobutyramide, Butanamide, 4-cyano-, 4-Cyano-butanamide, 4-cyano-butyric acid amide
| Molecular Formula | C5H8N2O |
|---|---|
| Molecular Weight | 112.06 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.06366 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 53897-27-1 |
|---|---|
| SMILES | C(CC#N)CC(=O)N |
| InChIKey | NHMAWNBVHVQDPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Cyanobutanamide (CAS 53897-27-1), with molecular formula C5H8N2O and molecular weight 112.06 g/mol. IUPAC: 4-cyanobutanamide.
Chemical Property Profile of 4-Cyanobutanamide
Property Insights of 4-Cyanobutanamide
The XLogP value of -0.9 indicates that 4-Cyanobutanamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Cyanobutanamide. Following Lipinski's Rule of Five, 4-Cyanobutanamide has 1 hydrogen bond donor(s) and 2 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 4-Cyanobutanamide?
The CAS number of 4-Cyanobutanamide is 53897-27-1.
What is the molecular formula of 4-Cyanobutanamide?
The molecular formula of 4-Cyanobutanamide is C5H8N2O.
What is the molecular weight of 4-Cyanobutanamide?
The molecular weight of 4-Cyanobutanamide is 112.06 g/mol.
Where can I buy 4-Cyanobutanamide?
You can request a quote for 4-Cyanobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyanobutanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyanobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.