5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile
TL;DR: 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile (CAS 1020416-38-9) is a chemical compound with molecular formula C8H11N5 and molecular weight 177.10144 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile
Also Known As: 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile, 5-amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile, 3-Amino-5-(Pyrrolidin-1-Yl)-1h-Pyrazole-4-Carbonitrile, 3-Amino-5-(1-pyrrolidinyl)-1H-pyrazole-4-carbonitrile, 5-azanyl-3-pyrrolidin-1-yl-1~{H}-pyrazole-4-carbonitrile
Technical Specifications
| Molecular Formula | C8H11N5 |
| Molecular Weight | 177.10144 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.10144 Da |
| Heavy Atoms | 13 |
| Complexity | 226.0 |
| SMILES | C1CCN(C1)C2=NNC(=C2C#N)N |
| InChIKey | RQDSNKYYHIZWJX-UHFFFAOYSA-N |
Chemical Property Profile of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile
Property Insights of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile has 2 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-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile?
The CAS number of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile is 1020416-38-9.
What is the molecular formula of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile?
The molecular formula of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile is C8H11N5.
What is the molecular weight of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile?
The molecular weight of 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile is 177.10144 g/mol.
Where can I buy 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile?
You can request a quote for 5-amino-3-(pyrrolidin-1-yl)-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-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-amino-3-(pyrrolidin-1-yl)-1H-pyrazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.