![3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium structure](/static/products/1030/1030389-82-2.webp)
3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium
TL;DR: 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium (CAS 1030389-82-2) is a chemical compound with molecular formula C16H18N3O3+ and molecular weight 300.13483 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-methyl-4-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
Also Known As: BAS 01248412, 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium, N-(2-methyl-4-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)propanamide
Technical Specifications
| Molecular Formula | C16H18N3O3+ |
| Molecular Weight | 300.13483 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.13483 Da |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
| SMILES | CC1=C[N+](=CC=C1)C(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C |
| InChIKey | OCOMBGIZWHRXTL-UHFFFAOYSA-O |
Chemical Property Profile of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium
Property Insights of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium. Following Lipinski's Rule of Five, 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium?
The CAS number of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium is 1030389-82-2.
What is the molecular formula of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium?
The molecular formula of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium is C16H18N3O3+.
What is the molecular weight of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium?
The molecular weight of 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium is 300.13483 g/mol.
Where can I buy 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium?
You can request a quote for 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium?
Yes, CoreyChem provides custom synthesis services for 3-Methyl-1-[1-(2-methyl-4-nitro-phenylcarbamoyl)-ethyl]-pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.