n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide
TL;DR: n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide (CAS 5831-70-9) is a chemical compound with molecular formula C7H8N4O and molecular weight 164.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-cyano-1-methylpyrazol-5-yl)acetamide
Also Known As: n-(4-cyano-1-methyl-1h-pyrazol-5-yl)acetamide, N-(4-cyano-2-methylpyrazol-3-yl)acetamide, N-(4-Chlorphenyl)-S,S-dimethylsulfimid, N-(4-cyano-2-methyl-pyrazol-3-yl)acetamide, 5-ACETAMIDO-1-METHYLPYRAZOLE-4-CARBONITRILE
| Molecular Formula | C7H8N4O |
|---|---|
| Molecular Weight | 164.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 164.06981 |
| Heavy Atoms | 12 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 5831-70-9 |
|---|---|
| SMILES | CC(=O)NC1=C(C=NN1C)C#N |
| InChIKey | NINCIFZSQMSSFI-UHFFFAOYSA-N |
Product Overview
n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide (CAS 5831-70-9), with molecular formula C7H8N4O and molecular weight 164.07 g/mol. IUPAC: N-(4-cyano-1-methylpyrazol-5-yl)acetamide.
Chemical Property Profile of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide
Property Insights of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide. Following Lipinski's Rule of Five, n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide 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-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide?
The CAS number of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide is 5831-70-9.
What is the molecular formula of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide?
The molecular formula of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide is C7H8N4O.
What is the molecular weight of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide?
The molecular weight of n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide is 164.07 g/mol.
Where can I buy n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide?
You can request a quote for n-(4-Cyano-1-methyl-1h-pyrazol-5-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-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.