TL;DR: N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide (CAS 1005177-73-0) is a chemical compound with molecular formula C15H22BrN3O and molecular weight 339.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-1-ethylpyrazole-5-carboxamide
Also Known As: N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide, N-(1-bicyclo[2.2.1]hept-2-ylethyl)-4-bromo-1-ethyl-1H-pyrazole-5-carboxamide, N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide, N-[1-(bicyclo[2.2.1]hept-2-yl)ethyl]-4-bromo-1-ethyl-1H-pyrazole-5-carboxamide, N~5~-(1-BICYCLO[2.2.1]HEPT-2-YLETHYL)-4-BROMO-1-ETHYL-1H-PYRAZOLE-5-CARBOXAMIDE
| Molecular Formula | C15H22BrN3O |
| Molecular Weight | 339.09464 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.09464 Da |
| Heavy Atoms | 20 |
| Complexity | 378.0 |
| SMILES | CCN1C(=C(C=N1)Br)C(=O)NC(C)C2CC3CCC2C3 |
| InChIKey | GECMJNFVFQYWGE-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide 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-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide is 1005177-73-0.
The molecular formula of N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide is C15H22BrN3O.
The molecular weight of N-[1-(3-bicyclo[2.2.1]heptanyl)ethyl]-4-bromo-2-ethylpyrazole-3-carboxamide is 339.09464 g/mol.
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