Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate
TL;DR: Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate (CAS 440111-67-1) is a chemical compound with molecular formula C12H14F3N3O3 and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-acetamido-3,3,3-trifluoro-2-[(6-methyl-2-pyridinyl)amino]propanoate
Also Known As: Methyl 2-acetamido-3,3,3-trifluoro-2-[(6-methylpyridin-2-yl)amino]propanoate, methyl 2-(acetylamino)-3,3,3-trifluoro-N-(6-methylpyridin-2-yl)alaninate, 2-Acetylamino-3,3,3-trifluoro-2-(6-methyl-pyridin-2-ylamino)-propionic acid methyl ester, methyl 2-(acetylamino)-3,3,3-trifluoro-2-[(6-methylpyridin-2-yl)amino]propanoate, methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate
| Molecular Formula | C12H14F3N3O3 |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 1.36962 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.09872 |
| Heavy Atoms | 21 |
| Complexity | 548.0394 |
Chemical Identifiers
| CAS Number | 440111-67-1 |
|---|---|
| SMILES | CC1=NC(=CC=C1)NC(C(=O)OC)(C(F)(F)F)NC(=O)C |
Product Overview
Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate (CAS 440111-67-1), with molecular formula C12H14F3N3O3 and molecular weight 305.10 g/mol. IUPAC: methyl 2-acetamido-3,3,3-trifluoro-2-[(6-methyl-2-pyridinyl)amino]propanoate.
Chemical Property Profile of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate
Property Insights of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate
The XLogP value of 1.36962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate. Following Lipinski's Rule of Five, Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate has 2 hydrogen bond donor(s) and 5 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 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate?
The CAS number of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate is 440111-67-1.
What is the molecular formula of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate?
The molecular formula of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate is C12H14F3N3O3.
What is the molecular weight of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate?
The molecular weight of Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate is 305.10 g/mol.
Where can I buy Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate?
You can request a quote for Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-acetamido-3,3,3-trifluoro-2-((6-methylpyridin-2-yl)amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.