[2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]methanol

C₁₉H₁₆FNOCAS 121660-11-5293.34 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₁₉H₁₆FNO
Molar mass: 293.34 g/mol
Exact mass: 293.1216 Da
logP: 4.41Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

121660-11-5

SMILES

OCc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1

InChIKey

FIZDBNPUFMDGFZ-UHFFFAOYSA-N

InChI

InChI=1S/C19H16FNO/c20-14-9-7-12(8-10-14)18-15-3-1-2-4-17(15)21-19(13-5-6-13)16(18)11-22/h1-4,7-10,13,22H,5-6,11H2

Weigh it out

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Names and synonyms

5 names

3-Quinolinemethanol, 2-cyclopropyl-4-(4-fluorophenyl)-
2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinemethanol
2-Cyclopropyl-4-(4′-fluorophenyl) quinolyl-3-methanol
2-Cyclopropyl-3-(hydroxymethyl)-4-(4-fluorophenyl)quinoline
(2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)methanol

Work with [2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]methanol

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

3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline154057-56-474 % similar [2-Cyclopropyl-4-(4-fluorophenyl)-quinolin-3-ylmethyl]-triphenyl-phosphonium bromido154057-58-664 % similar 2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxaldehyde121660-37-562 % similar (2E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenal148901-68-257 % similar (E)-3-(2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)acrylonitrile256431-72-857 % similar Methyl 2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinecarboxylate121659-86-755 % similar Pitavastatin lactone141750-63-247 % similar Pitavastatin147511-69-147 % similar

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

Elsewhere

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