TL;DR: ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate (CAS 114936-20-8) is a chemical compound with molecular formula C9H15N5O2 and molecular weight 225.12257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate
Also Known As: ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate, ethyl N-[(5-amino-1-methyl-1H-pyrazol-4-yl)carbonyl]ethanehydrazonoate, Ethyl N-[(5-amino-1-methyl-1H-pyrazol-4-yl)-carbonyl]ethanehydrazonoate, 1H-Pyrazole-4-carboxylicacid, 5-amino-1-methyl-, 2-(1-ethoxyethylidene)hydrazide, Ethyl N'-(5-amino-1-methyl-1H-pyrazole-4-carbonyl)acetohydrazonate
| Molecular Formula | C9H15N5O2 |
| Molecular Weight | 225.12257 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.12257 Da |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
| SMILES | CCOC(=NNC(=O)C1=C(N(N=C1)C)N)C |
| InChIKey | LKBDLUGBWAFBBL-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate. Following Lipinski's Rule of Five, ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate is 114936-20-8.
The molecular formula of ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate is C9H15N5O2.
The molecular weight of ethyl N-(5-amino-1-methylpyrazole-4-carbonyl)ethanehydrazonate is 225.12257 g/mol.
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