5-Amino-2-(trifluoromethyl)pyridine

C₆H₅F₃N₂CAS 106877-33-2162.12 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₆H₅F₃N₂
Molar mass: 162.12 g/mol
Exact mass: 162.0405 Da
logP: 1.68Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

106877-33-2

SMILES

C1=CC(=NC=C1N)C(F)(F)F

InChIKey

IBOZOWZSXZNIHI-UHFFFAOYSA-N

InChI

InChI=1S/C6H5F3N2/c7-6(8,9)5-2-1-4(10)3-11-5/h1-3H,10H2

Weigh it out

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

Work with 5-Amino-2-(trifluoromethyl)pyridine

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

6-(Trifluoromethyl)-3-pyridinol216766-12-053 % similar 5-Methoxy-2-(trifluoromethyl)pyridine216766-13-148 % similar 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-948 % similar 6-Fluoro-3-pyridinamine1827-27-648 % similar 4-(Trifluoromethyl)aniline455-14-146 % similar 6-(Trifluoromethyl)pyridine-3-amidine hydrochloride221313-11-745 % similar 6-Trifluoromethylnicotinic acid231291-22-844 % similar 6-(Trifluoromethyl)-3-pyridinecarboxamide386715-35-144 % similar

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

Same formula

2-Amino-4-(trifluoromethyl)pyridine106447-97-6 5-(Trifluoromethyl)pyridin-3-amine112110-07-3 3-Amino-4-trifluoromethylpyridine175204-80-5 4-Amino-3-trifluoromethylpyridine387824-61-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook