chempirical

Azaperone

C19H22FN3OCAS 1649-18-9327.40 g/mol

Open in Covalent MOL file
ONNNF
Aryl halideKetoneTertiary amine

Properties

Molecular formula
C19H22FN3O
Molar mass
327.40 g/mol
Exact mass
327.1747 Da
Melting point
73–75 °C
logP
3.01Crippen estimate
Polar surface area
36.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number
1649-18-9
SMILES
O=C(CCCN1CCN(c2ccccn2)CC1)c1ccc(F)cc1
InChIKey
XTKDAFGWCDAMPY-UHFFFAOYSA-N
InChI
InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2

Weigh it out

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

Names and synonyms

9 names
  • 1-Butanone, 1-(4-fluorophenyl)-4-[4-(2-pyridinyl)-1-piperazinyl]-
  • Butyrophenone, 4′-fluoro-4-[4-(2-pyridyl)-1-piperazinyl]-
  • 1-(4-Fluorophenyl)-4-[4-(2-pyridinyl)-1-piperazinyl]-1-butanone
  • 4′-Fluoro-4-[4-(2-pyridyl)-1-piperazinyl]butyrophenone
  • Fluoperidol
  • Stresnil
  • R-1929
  • Suicalm
  • NSC 170976

Work with Azaperone

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

Fluanisone1480-19-959 % similar Benperidol2062-84-248 % similar Pipamperone1893-33-048 % similar Bromperidol10457-90-646 % similar Haloperidol52-86-846 % similar 4-Chloro-1-(4-fluorophenyl)-1-butanone3874-54-245 % similar Droperidol548-73-243 % similar 4-Fluoro-δ-oxobenzenepentanoic acid149437-76-343 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook