1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole
TL;DR: 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole (CAS 62564-58-3) is a chemical compound with molecular formula C8H10N4O and molecular weight 178.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(4-cyano-1-methylpyrazol-5-yl)methanimidate
Also Known As: ethyl N-(4-cyano-2-methylpyrazol-3-yl)methanimidate, 1-methyl-4-cyano-5-ethoxymethyleneaminopyrazole, Ethyl (4-cyano-1-methyl-1H-pyrazol-5-yl)methanimidate, Ethyl N-(4-cyano-1-methyl-1H-pyrazol-5-yl)methanimidate, 5-(ETHOXYMETHYLIDENEAMINO)-1-METHYL-PYRAZOLE-4-CARBONITRILE
| Molecular Formula | C8H10N4O |
|---|---|
| Molecular Weight | 178.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.08546 |
| Heavy Atoms | 13 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 62564-58-3 |
|---|---|
| SMILES | CCOC=NC1=C(C=NN1C)C#N |
| InChIKey | YTJWDKLDTLAAMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole (CAS 62564-58-3), with molecular formula C8H10N4O and molecular weight 178.09 g/mol. IUPAC: ethyl N-(4-cyano-1-methylpyrazol-5-yl)methanimidate.
Chemical Property Profile of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole
Property Insights of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole. Following Lipinski's Rule of Five, 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole has 0 hydrogen bond donor(s) and 4 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 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole?
The CAS number of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole is 62564-58-3.
What is the molecular formula of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole?
The molecular formula of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole is C8H10N4O.
What is the molecular weight of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole?
The molecular weight of 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole is 178.09 g/mol.
Where can I buy 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole?
You can request a quote for 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-cyano-5-ethoxymethyleneaminopyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.