2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide
TL;DR: 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide (CAS 1087712-61-5) is a chemical compound with molecular formula C6H8ClN3O and molecular weight 173.03558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-(1-methylpyrazol-4-yl)acetamide
Also Known As: Potassiumoleate, 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide, 2-Chloro-N-(1-methyl-1H-pyrazol-4-yl)-acetamide, 2-chloro-N-(1-methylpyrazol-4-yl)acetamide, 4420AF
Technical Specifications
| Molecular Formula | C6H8ClN3O |
| Molecular Weight | 173.03558 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.03558 Da |
| Heavy Atoms | 11 |
| Complexity | 153.0 |
| SMILES | CN1C=C(C=N1)NC(=O)CCl |
| InChIKey | JKMBFTFWNDHJCA-UHFFFAOYSA-N |
Chemical Property Profile of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide
Property Insights of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide. With a topological polar surface area (TPSA) of 46.9 Ų, 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide?
The CAS number of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide is 1087712-61-5.
What is the molecular formula of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide?
The molecular formula of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide is C6H8ClN3O.
What is the molecular weight of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide?
The molecular weight of 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide is 173.03558 g/mol.
Where can I buy 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide?
You can request a quote for 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for 2-chloro-N-(1-methyl-1H-pyrazol-4-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.