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5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile
TL;DR: 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile (CAS 1026783-37-8) is a chemical compound with molecular formula C10H9N5 and molecular weight 199.0858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(pyridin-3-ylmethylamino)-1H-pyrazole-4-carbonitrile
Also Known As: ZERO/005492, 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile, 5-(pyridin-3-ylmethylamino)-1H-pyrazole-4-carbonitrile, 5-[(3-pyridylmethyl)amino]pyrazole-4-carbonitrile, 1H-Pyrazole-4-carbonitrile, 5-[(3-pyridinylmethyl)amino]-
Technical Specifications
| Molecular Formula | C10H9N5 |
| Molecular Weight | 199.0858 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.0858 Da |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
| SMILES | C1=CC(=CN=C1)CNC2=C(C=NN2)C#N |
| InChIKey | NJRRRTBCGBWZOF-UHFFFAOYSA-N |
Chemical Property Profile of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile
Property Insights of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-[(pyridin-3-ylmethyl)amino]-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-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile?
The CAS number of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile is 1026783-37-8.
What is the molecular formula of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile?
The molecular formula of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile is C10H9N5.
What is the molecular weight of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile?
The molecular weight of 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile is 199.0858 g/mol.
Where can I buy 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile?
You can request a quote for 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.