Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate
TL;DR: Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate (CAS 1491139-74-2) is a chemical compound with molecular formula C13H26N2O3 and molecular weight 258.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate
Also Known As: Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate, methyl N-[(3-methylbutyl)carbamoyl]isoleucinate, methyl 2-(isopentylcarbamoylamino)-3-methyl-pentanoate, METHYL 3-METHYL-2-{[(3-METHYLBUTYL)CARBAMOYL]AMINO}PENTANOATE
| Molecular Formula | C13H26N2O3 |
|---|---|
| Molecular Weight | 258.19 g/mol |
| LogP | 1.9194 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 258.19434 |
| Heavy Atoms | 18 |
| Complexity | 266.96198 |
Chemical Identifiers
| CAS Number | 1491139-74-2 |
|---|---|
| SMILES | CCC(C)C(C(=O)OC)NC(=O)NCCC(C)C |
Product Overview
Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate (CAS 1491139-74-2), with molecular formula C13H26N2O3 and molecular weight 258.19 g/mol. IUPAC: methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate.
Chemical Property Profile of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate
Property Insights of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate
The XLogP value of 1.9194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate. Following Lipinski's Rule of Five, Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate has 2 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 Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate?
The CAS number of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate is 1491139-74-2.
What is the molecular formula of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate?
The molecular formula of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate is C13H26N2O3.
What is the molecular weight of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate?
The molecular weight of Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate is 258.19 g/mol.
Where can I buy Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate?
You can request a quote for Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-2-(3-methylbutylcarbamoylamino)pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.