TL;DR: N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine (CAS 1185304-12-4) is a chemical compound with molecular formula C10H19N3 and molecular weight 181.1579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]ethanamine
Also Known As: N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine, n-[(1-ethyl-3,5-dimethyl-1h-pyrazol-4-yl)methyl]-ethanamine, 3897AF, ethyl[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amine, ethyl[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]amine
| Molecular Formula | C10H19N3 |
| Molecular Weight | 181.1579 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.1579 Da |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
| SMILES | CCNCC1=C(N(N=C1C)CC)C |
| InChIKey | NWFRQPJKLCWABC-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine. With a topological polar surface area (TPSA) of 29.9 Ų, N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine is 1185304-12-4.
The molecular formula of N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine is C10H19N3.
The molecular weight of N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine is 181.1579 g/mol.
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