IUPAC name
2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid
SMILES
OC(=O)C1=C(NC2=CC=CC(=C2)C(F)(F)F)N=CC=C1
Compound class
Anti-Inflammatory Agents, Non-Steroidal; Cyclooxygenase Inhibitors; Musculo-Skeletal System; Antiinflammatory and Antirheumatic Products, Non-Steroids; Antiinflammatory and Antirheumatic Products; Antiinflammatory Preparations, Non-Steroids for Topical Use; Topical Products for Joint and Muscular Pain;
Therapeutic area
Used in the treatment of rheumatoid arthritis.
Common name
Niflumic Acid
IUPAC name
2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid
SMILES
OC(=O)C1=C(NC2=CC=CC(=C2)C(F)(F)F)N=CC=C1
INCHI
InChI=1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)
FORMULA
C13H9F3N2O2
Common name
Niflumic Acid
IUPAC name
2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid
Molecular weight
282.218
clogP
2.596
clogS
-3.791
HBond Acceptor
3
HBond Donor
2
Total Polar Surface Area
62.22
Number of Rings
2
Rotatable Bond
4
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF00046 | aniline |
|
Nc1ccccc1 | 0.0247 |
| FDBF00162 | trifluoromethylbenzene |
|
c1ccc(cc1)C(F)(F)F | 0.0172 |
| FDBF00177 | fluoroform |
|
FC(F)F | 0.0704 |
| FDBF01433 | nicotinic acid |
|
n1cc(ccc1)C(=O)O | 0.0027 |
| FDBF03151 | 3-(trifluoromethyl)aniline |
|
c1(cc(ccc1)C(F)(F)F)N | 0.0014 |
