2-methyl-N-(2-methyl-5-nitrophenyl)propanamide
TL;DR: 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide (CAS 77252-58-5) is a chemical compound with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(2-methyl-5-nitrophenyl)propanamide
Also Known As: 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide, N-(2-methyl-5-nitrophenyl)isobutyramide, Cambridge id 5570738
| Molecular Formula | C11H14N2O3 |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 2.49772 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.10045 |
| Heavy Atoms | 16 |
| Complexity | 427.23788 |
Chemical Identifiers
| CAS Number | 77252-58-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)C |
Product Overview
2-methyl-N-(2-methyl-5-nitrophenyl)propanamide (CAS 77252-58-5), with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol. IUPAC: 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide.
Chemical Property Profile of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide
Property Insights of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide
The XLogP value of 2.49772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide. Following Lipinski's Rule of Five, 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide 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
Frequently Asked Questions
What is the CAS number of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide?
The CAS number of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide is 77252-58-5.
What is the molecular formula of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide?
The molecular formula of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide is C11H14N2O3.
What is the molecular weight of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide?
The molecular weight of 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide is 222.10 g/mol.
Where can I buy 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide?
You can request a quote for 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-N-(2-methyl-5-nitrophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.