N-Hydroxy-4-(trifluoromethyl)-3-pyridinecarboximidamide

C₇H₆F₃N₃OCAS 175204-85-0205.14 g/mol

Open in Covalent MOL file

Alkyl halide Amidine

Properties

Molecular formula: C₇H₆F₃N₃O
Molar mass: 205.14 g/mol
Exact mass: 205.0463 Da
logP: 1.40Crippen estimate
Polar surface area: 69.0 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 1

Identifiers

CAS number

175204-85-0

SMILES

N=C(NO)c1cnccc1C(F)(F)F

InChIKey

TWNDDLQXEIPJNK-UHFFFAOYSA-N

InChI

InChI=1S/C7H6F3N3O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13-14/h1-3,14H,(H2,11,13)

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

Names and synonyms

1 names

3-Pyridinecarboximidamide, N-hydroxy-4-(trifluoromethyl)-

Work with N-Hydroxy-4-(trifluoromethyl)-3-pyridinecarboximidamide

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-Trifluoromethylnicotinamide158062-71-662 % similar Flonicamid158062-67-047 % similar 3-Fluoro-4-(trifluoromethyl)pyridine113770-87-944 % similar 3-Amino-4-trifluoromethylpyridine175204-80-543 % similar 3-Chloro-4-(trifluoromethyl)pyridine81565-19-743 % similar 4-(Trifluoromethyl)-3-pyridinecarbonitrile13600-43-640 % similar N-Hydroxy-2-pyridinecarboximidamide1772-01-637 % similar 2-(Trifluoromethyl)benzamide360-64-537 % similar

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

Elsewhere

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