TL;DR: 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide (CAS 957479-91-3) is a chemical compound with molecular formula C16H18N4O2 and molecular weight 298.14297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide
Also Known As: 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide, 1-methyl-N-[4-(pyrrolidin-1-ylcarbonyl)phenyl]-1H-pyrazole-5-carboxamide, 1-METHYL-N-[4-(PYRROLIDINE-1-CARBONYL)PHENYL]-1H-PYRAZOLE-5-CARBOXAMIDE
| Molecular Formula | C16H18N4O2 |
| Molecular Weight | 298.14297 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.14297 Da |
| Heavy Atoms | 22 |
| Complexity | 414.0 |
| SMILES | CN1C(=CC=N1)C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3 |
| InChIKey | XMSCXDMJNWIZPZ-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide is 957479-91-3.
The molecular formula of 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide is C16H18N4O2.
The molecular weight of 2-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide is 298.14297 g/mol.
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