TL;DR: 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide (CAS 1005640-15-2) is a chemical compound with molecular formula C11H12ClN3O2 and molecular weight 253.0618 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide
Also Known As: 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide, 2-(4-chloro-3-methylpyrazolyl)-N-(2-furylmethyl)acetamide, 2-(4-chloro-3-methyl-pyrazol-1-yl)-N-(2-furylmethyl)acetamide, 2-(4-CHLORO-3-METHYL-1H-PYRAZOL-1-YL)-N-(2-FURYLMETHYL)ACETAMIDE, 2-(4-chloro-3-methyl-1H-pyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide
| Molecular Formula | C11H12ClN3O2 |
| Molecular Weight | 253.0618 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 60.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.0618 Da |
| Heavy Atoms | 17 |
| Complexity | 277.0 |
| SMILES | CC1=NN(C=C1Cl)CC(=O)NCC2=CC=CO2 |
| InChIKey | PXPPIESFAGRHTP-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide. The TPSA of 60.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide. Following Lipinski's Rule of Five, 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide 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 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide is 1005640-15-2.
The molecular formula of 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide is C11H12ClN3O2.
The molecular weight of 2-(4-chloro-3-methylpyrazol-1-yl)-N-(furan-2-ylmethyl)acetamide is 253.0618 g/mol.
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