Pyrazole, 3-amino-4-cyano-5-ethyl-
TL;DR: Pyrazole, 3-amino-4-cyano-5-ethyl- (CAS 63680-91-1) is a chemical compound with molecular formula C6H8N4 and molecular weight 136.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-ethyl-1H-pyrazole-4-carbonitrile
Also Known As: 3-amino-5-ethyl-1h-pyrazole-4-carbonitrile, 3-Amino-4-cyano-5-ethyl pyrazole, Pyrazole, 3-amino-4-cyano-5-ethyl-, 2-Phenylacrylic Acid Ethyl Ester, Pyrazole,3-amino-4-cyano-5-ethyl
| Molecular Formula | C6H8N4 |
|---|---|
| Molecular Weight | 136.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.07489 |
| Heavy Atoms | 10 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 63680-91-1 |
|---|---|
| SMILES | CCC1=C(C(=NN1)N)C#N |
| InChIKey | OUKWXMBLFGLIOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrazole, 3-amino-4-cyano-5-ethyl- (CAS 63680-91-1), with molecular formula C6H8N4 and molecular weight 136.07 g/mol. IUPAC: 3-amino-5-ethyl-1H-pyrazole-4-carbonitrile.
Chemical Property Profile of Pyrazole, 3-amino-4-cyano-5-ethyl-
Property Insights of Pyrazole, 3-amino-4-cyano-5-ethyl-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazole, 3-amino-4-cyano-5-ethyl-. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazole, 3-amino-4-cyano-5-ethyl-. Following Lipinski's Rule of Five, Pyrazole, 3-amino-4-cyano-5-ethyl- has 2 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 Pyrazole, 3-amino-4-cyano-5-ethyl-?
The CAS number of Pyrazole, 3-amino-4-cyano-5-ethyl- is 63680-91-1.
What is the molecular formula of Pyrazole, 3-amino-4-cyano-5-ethyl-?
The molecular formula of Pyrazole, 3-amino-4-cyano-5-ethyl- is C6H8N4.
What is the molecular weight of Pyrazole, 3-amino-4-cyano-5-ethyl-?
The molecular weight of Pyrazole, 3-amino-4-cyano-5-ethyl- is 136.07 g/mol.
Where can I buy Pyrazole, 3-amino-4-cyano-5-ethyl-?
You can request a quote for Pyrazole, 3-amino-4-cyano-5-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole, 3-amino-4-cyano-5-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole, 3-amino-4-cyano-5-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.