2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide
TL;DR: 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide (CAS 1002695-93-3) is a chemical compound with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-methylacetamide
Also Known As: 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide, 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-methylacetamide
| Molecular Formula | C8H12N4O3 |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | 0.15414 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.09094 |
| Heavy Atoms | 15 |
| Complexity | 410.26443 |
Chemical Identifiers
| CAS Number | 1002695-93-3 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC)C)[N+](=O)[O-] |
Product Overview
2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide (CAS 1002695-93-3), with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol. IUPAC: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-methylacetamide.
Chemical Property Profile of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide
Property Insights of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide
The XLogP value of 0.15414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide. Following Lipinski's Rule of Five, 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The CAS number of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide is 1002695-93-3.
What is the molecular formula of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The molecular formula of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide is C8H12N4O3.
What is the molecular weight of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
The molecular weight of 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide is 212.09 g/mol.
Where can I buy 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
You can request a quote for 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.