N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide
TL;DR: N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide (CAS 57520-67-9) is a chemical compound with molecular formula C14H12F3N3O and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
Also Known As: N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide, AJ-333/36117028, N-methyl-2-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
| Molecular Formula | C14H12F3N3O |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | 3.2036 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.09326 |
| Heavy Atoms | 21 |
| Complexity | 655.90765 |
Chemical Identifiers
| CAS Number | 57520-67-9 |
|---|---|
| SMILES | CNC(=O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F |
Product Overview
N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide (CAS 57520-67-9), with molecular formula C14H12F3N3O and molecular weight 295.09 g/mol. IUPAC: N-methyl-2-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide.
Chemical Property Profile of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide
Property Insights of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide
The XLogP value of 3.2036 indicates that N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide 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 N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide?
The CAS number of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide is 57520-67-9.
What is the molecular formula of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide?
The molecular formula of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide is C14H12F3N3O.
What is the molecular weight of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide?
The molecular weight of N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide is 295.09 g/mol.
Where can I buy N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide?
You can request a quote for N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-2-[3-(trifluoromethyl)anilino]nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.