N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide
TL;DR: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide (CAS 557779-34-7) is a chemical compound with molecular formula C11H14N2OS and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide
Also Known As: Propanamide,N- -, N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide, N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)propanamide, Propanamide, N-(3-cyano-4-ethyl-5-methyl-2-thienyl)- (9CI)
| Molecular Formula | C11H14N2OS |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 2.8391 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.08269 |
| Heavy Atoms | 15 |
| Complexity | 414.9578 |
Chemical Identifiers
| CAS Number | 557779-34-7 |
|---|---|
| SMILES | CCC1=C(SC(=C1C#N)NC(=O)CC)C |
Product Overview
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide (CAS 557779-34-7), with molecular formula C11H14N2OS and molecular weight 222.08 g/mol. IUPAC: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide.
Chemical Property Profile of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide
Property Insights of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide
The XLogP value of 2.8391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide has 1 hydrogen bond donor(s) and 3 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 N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide?
The CAS number of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide is 557779-34-7.
What is the molecular formula of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide?
The molecular formula of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide is C11H14N2OS.
What is the molecular weight of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide?
The molecular weight of N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide is 222.08 g/mol.
Where can I buy N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide?
You can request a quote for N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.