![2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid structure](/static/products/1396/1396967-38-6.webp)
2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid
TL;DR: 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid (CAS 1396967-38-6) is a chemical compound with molecular formula C12H22N2O3 and molecular weight 242.16304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(cyclohexylcarbamoylamino)-3-methylbutanoic acid
Also Known As: N-(Cyclohexylcarbamoyl)valine, 2-[(cyclohexylcarbamoyl)amino]-3-methylbutanoic acid, Valine, N-[(cyclohexylamino)carbonyl]-, 2-{[(cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid, 2-(cyclohexylcarbamoylamino)-3-methylbutanoic acid
Technical Specifications
| Molecular Formula | C12H22N2O3 |
| Molecular Weight | 242.16304 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.16304 Da |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
| SMILES | CC(C)C(C(=O)O)NC(=O)NC1CCCCC1 |
| InChIKey | LYSPLFOJTNNDFB-UHFFFAOYSA-N |
Chemical Property Profile of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid
Property Insights of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid. Following Lipinski's Rule of Five, 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid has 3 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 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid?
The CAS number of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid is 1396967-38-6.
What is the molecular formula of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid?
The molecular formula of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid is C12H22N2O3.
What is the molecular weight of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid?
The molecular weight of 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid is 242.16304 g/mol.
Where can I buy 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid?
You can request a quote for 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-{[(Cyclohexylamino)carbonyl]amino}-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.