TL;DR: 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide (CAS 1015844-93-5) 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.
5-(pyridin-3-ylmethylamino)-1H-pyrazole-4-carboxamide
Also Known As: ZERO/008395, 3-[(3-Pyridinylmethyl)amino]-1H-pyrazole-4-carboxamide, 5-[(Pyridin-3-Ylmethyl)amino]-1h-Pyrazole-4-Carboxamide, AB01329191-02, 3-[(3-pyridylmethyl)amino]pyrazole-4-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(C=NN2)C(=O)N |
| InChIKey | LBLVYSJDBWSBHZ-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide. Following Lipinski's Rule of Five, 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-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 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide is 1015844-93-5.
The molecular formula of 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide is C10H11N5O.
The molecular weight of 3-((3-Pyridinylmethyl)amino)-1H-pyrazole-4-carboxamide is 217.09636 g/mol.
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