N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide
TL;DR: N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide (CAS 54760-14-4) is a chemical compound with molecular formula C13H11N3O and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide
Also Known As: N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide, 2-acetamido-3-cyano-4-phenylpyrrole, N-(3-cyano-4-phenylpyrrol-2-yl)acetamide, 2-acetylamino-4-phenyl-pyrrole-3-carbonitrile, Acetamide, N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-
| Molecular Formula | C13H11N3O |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 2.51178 |
| Topological Polar Surface Area | 68.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.09021 |
| Heavy Atoms | 17 |
| Complexity | 578.4572 |
Chemical Identifiers
| CAS Number | 54760-14-4 |
|---|---|
| SMILES | CC(=O)NC1=C(C(=CN1)C2=CC=CC=C2)C#N |
Product Overview
N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide (CAS 54760-14-4), with molecular formula C13H11N3O and molecular weight 225.09 g/mol. IUPAC: N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide.
Chemical Property Profile of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide
Property Insights of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide
The XLogP value of 2.51178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide. The TPSA of 68.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide. Following Lipinski's Rule of Five, N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide 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
Frequently Asked Questions
What is the CAS number of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide?
The CAS number of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide is 54760-14-4.
What is the molecular formula of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide?
The molecular formula of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide is C13H11N3O.
What is the molecular weight of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide?
The molecular weight of N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide is 225.09 g/mol.
Where can I buy N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide?
You can request a quote for N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide 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-phenyl-1H-pyrrol-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.