5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile
TL;DR: 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile (CAS 116884-64-1) is a chemical compound with molecular formula C11H10N4O and molecular weight 214.08546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-1-(4-methoxyphenyl)pyrazole-4-carbonitrile
Also Known As: 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile, 5-amino-1-(4-methoxyphenyl)pyrazole-4-carbonitrile, aminomethoxyphenylpyrazolecarbonitrile, 1H-Pyrazole-4-carbonitrile, 5-amino-1-(4-methoxyphenyl)-, 2755AA
Technical Specifications
| Molecular Formula | C11H10N4O |
| Molecular Weight | 214.08546 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.08546 Da |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
| SMILES | COC1=CC=C(C=C1)N2C(=C(C=N2)C#N)N |
| InChIKey | AIQYZOPCGVEHML-UHFFFAOYSA-N |
Chemical Property Profile of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile
Property Insights of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile?
The CAS number of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile is 116884-64-1.
What is the molecular formula of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile?
The molecular formula of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile is C11H10N4O.
What is the molecular weight of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile?
The molecular weight of 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile is 214.08546 g/mol.
Where can I buy 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile?
You can request a quote for 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-amino-1-(4-methoxyphenyl)-1H-pyrazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.