chempirical

1,2-Dihydro-2-oxo-6-(trifluoromethyl)-3-pyridinecarboxamide

C7H5F3N2O2CAS 116548-03-9206.12 g/mol

Open in Covalent MOL file
H2NOFFFNHO
Alkyl halideAmidePhenol

Properties

Molecular formula
C7H5F3N2O2
Molar mass
206.12 g/mol
Exact mass
206.0303 Da
Melting point
220–222 °C
logP
0.90Crippen estimate
Polar surface area
76.2 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
116548-03-9
SMILES
NC(=O)c1ccc(C(F)(F)F)nc1O
InChIKey
BZMWJLRKOIRLSU-UHFFFAOYSA-N
InChI
InChI=1S/C7H5F3N2O2/c8-7(9,10)4-2-1-3(5(11)13)6(14)12-4/h1-2H,(H2,11,13)(H,12,14)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 3-Pyridinecarboxamide, 1,2-dihydro-2-oxo-6-(trifluoromethyl)-
  • 2-Hydroxy-6-trifluoromethylnicotinamide
  • 1,2-Dihydro-2-oxo-6-(trifluoromethyl)pyridine-3-carboxylic acid amide
  • 2-Oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carboxamide
  • 2-Oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
  • 2-Hydroxy-6-(trifluoromethyl)pyridine-3-carboxamide

Work with 1,2-Dihydro-2-oxo-6-(trifluoromethyl)-3-pyridinecarboxamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-(Trifluoromethyl)benzamide1891-90-342 % similar 6-Trifluoromethyl-2-pyridinecarboxylic acid131747-42-739 % similar Favipiravir259793-96-939 % similar 2-(Trifluoromethoxy)benzamide127979-74-236 % similar 6-Trifluoromethylnicotinic acid231291-22-836 % similar 2-Fluoro-6-(trifluoromethyl)pyridine94239-04-035 % similar 3-Amino-2-chloro-6-(trifluoromethyl)pyridine117519-09-235 % similar 2-Methyl-6-(trifluoromethyl)-3-pyridinamine383907-17-335 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Nitro-2-(trifluoromethyl)aniline121-01-7 4-Nitro-3-(trifluoromethyl)aniline393-11-3 2-Nitro-4-(trifluoromethyl)aniline400-98-6 3-Nitro-5-(trifluoromethyl)benzenamine401-94-5

Elsewhere

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