TL;DR: 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide (CAS 1197227-71-6) is a chemical compound with molecular formula C14H18N4O and molecular weight 258.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-1-ethyl-N-(2-phenylethyl)pyrazole-3-carboxamide
Also Known As: 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide, 4-amino-1-ethyl-N-(2-phenylethyl)-1H-pyrazole-3-carboxamide, 4-Amino-1-ethyl-1H-pyrazole-3-carboxylic acid phenethyl-amide, 4-amino-1-ethyl-N-(2-phenylethyl)pyrazole-3-carboxamide, (4-amino-1-ethylpyrazol-3-yl)-N-(2-phenylethyl)carboxamide
| Molecular Formula | C14H18N4O |
| Molecular Weight | 258.14807 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.14807 Da |
| Heavy Atoms | 19 |
| Complexity | 291.0 |
| SMILES | CCN1C=C(C(=N1)C(=O)NCCC2=CC=CC=C2)N |
| InChIKey | MXBUMGUUYVWKQE-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide has 2 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 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide is 1197227-71-6.
The molecular formula of 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide is C14H18N4O.
The molecular weight of 4-Amino-1-ethyl-N-phenethyl-1H-pyrazole-3-carboxamide is 258.14807 g/mol.
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