TL;DR: N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide (CAS 1005622-64-9) is a chemical compound with molecular formula C12H16IN5O and molecular weight 373.03995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-1-methylpyrazole-5-carboxamide
Also Known As: N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide, N-[1-(1,3-dimethyl-1H-pyrazol-4-yl)ethyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide, N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methyl-pyrazole-3-carboxamide
| Molecular Formula | C12H16IN5O |
| Molecular Weight | 373.03995 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 64.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.03995 Da |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
| SMILES | CC1=NN(C=C1C(C)NC(=O)C2=C(C=NN2C)I)C |
| InChIKey | AZTQVCPSTNWYJD-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-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 N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide is 1005622-64-9.
The molecular formula of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide is C12H16IN5O.
The molecular weight of N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-iodo-2-methylpyrazole-3-carboxamide is 373.03995 g/mol.
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