TL;DR: 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide (CAS 1042767-36-1) is a chemical compound with molecular formula C10H11N5O and molecular weight 217.09636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(pyridin-3-ylmethylamino)-1H-pyrazole-5-carboxamide
Also Known As: 4-((3-pyridylmethyl)amino)pyrazole-3-carboxamide, AB01333847-02, 4-[(3-pyridylmethyl)amino]pyrazole-5-carboxamide, 4-(pyridin-3-ylmethylamino)-1H-pyrazole-5-carboxamide, 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide
| Molecular Formula | C10H11N5O |
| Molecular Weight | 217.09636 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.09636 Da |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
| SMILES | C1=CC(=CN=C1)CNC2=C(NN=C2)C(=O)N |
| InChIKey | NTISDLQCNLGOFY-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide is 1042767-36-1.
The molecular formula of 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide is C10H11N5O.
The molecular weight of 4-[(pyridin-3-ylmethyl)amino]-1H-pyrazole-5-carboxamide is 217.09636 g/mol.
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