![2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid structure](/static/products/334/334506-73-9.png)
2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid
TL;DR: 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid (CAS 334506-73-9) is a chemical compound with molecular formula C16H23NO3 and molecular weight 277.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-(4-methylanilino)-5-oxo-2-propylpentanoic acid
Also Known As: BAS 02592676, 3-methyl-5-(4-methylanilino)-5-oxo-2-propylpentanoic acid, 2-(1-Methyl-2-p-tolylcarbamoyl-ethyl)-pentanoic acid, 3-methyl-5-oxo-2-propyl-5-(4-toluidino)pentanoic acid, 3-methyl-5-oxo-2-propyl-5-(p-tolylamino)pentanoic acid
| Molecular Formula | C16H23NO3 |
|---|---|
| Molecular Weight | 277.17 g/mol |
| LogP | 3.46062 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.1678 |
| Heavy Atoms | 20 |
| Complexity | 453.2947 |
Chemical Identifiers
| CAS Number | 334506-73-9 |
|---|---|
| SMILES | CCCC(C(C)CC(=O)NC1=CC=C(C=C1)C)C(=O)O |
Product Overview
2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid (CAS 334506-73-9), with molecular formula C16H23NO3 and molecular weight 277.17 g/mol. IUPAC: 3-methyl-5-(4-methylanilino)-5-oxo-2-propylpentanoic acid.
Chemical Property Profile of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid
Property Insights of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid
The XLogP value of 3.46062 indicates that 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid. Following Lipinski's Rule of Five, 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid has 2 hydrogen bond donor(s) and 2 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-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid?
The CAS number of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid is 334506-73-9.
What is the molecular formula of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid?
The molecular formula of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid is C16H23NO3.
What is the molecular weight of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid?
The molecular weight of 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid is 277.17 g/mol.
Where can I buy 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid?
You can request a quote for 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{1-methyl-2-[N-(4-methylphenyl)carbamoyl]ethyl}pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.