1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one

C14H12FNO — CID 62551750

IUPAC1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one
SMILESO=C(Cc1ccncc1)Cc1ccc(F)cc1
InChIInChI=1S/C14H12FNO/c15-13-3-1-11(2-4-13)9-14(17)10-12-5-7-16-8-6-12/h1-8H,9-10H2
InChIKeyGLPZPNLIFJTOBR-UHFFFAOYSA-N
MW229.25 g/mol
LogP2.58
Rot. Bonds4

About 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one

1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one (PubChem CID 62551750) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one
PubChem CID62551750
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one
SMILESO=C(Cc1ccncc1)Cc1ccc(F)cc1
InChIInChI=1S/C14H12FNO/c15-13-3-1-11(2-4-13)9-14(17)10-12-5-7-16-8-6-12/h1-8H,9-10H2
InChIKeyGLPZPNLIFJTOBR-UHFFFAOYSA-N
XLogP2.58
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-fluorophenyl)-2-pyridin-4-ylacetamide
CID 110697317
1-(2,3-difluorophenyl)-3-pyridin-4-ylpropan-2-one
CID 62622512
1-(dimethylamino)-3-pyridin-4-ylpropan-2-one
CID 79078210
N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide
CID 47011276
1-(4-fluorophenyl)pentane-2,4-dione
CID 57447744
1-(4-fluorophenyl)-3-thiophen-3-ylpropan-2-one
CID 62622073
1-(4-fluorophenyl)pent-4-en-2-one
CID 61380162
3-oxo-4-pyridin-4-ylbutanenitrile
CID 57109243
5-amino-1-pyridin-4-ylpentan-2-one
CID 116553409
1-(4-fluorophenyl)-3-(methylamino)propan-2-one
CID 83636230
1-(2-bromophenyl)-3-pyridin-4-ylpropan-2-one
CID 62551928
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-pyridin-4-ylethanone
CID 110697261

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one?
The IUPAC name of 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one (CID 62551750) is 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one is O=C(Cc1ccncc1)Cc1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one?
The InChIKey is GLPZPNLIFJTOBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO/c15-13-3-1-11(2-4-13)9-14(17)10-12-5-7-16-8-6-12/h1-8H,9-10H2.
What are the key properties of 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one?
1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one has a molecular weight of 229.25 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one is sourced from PubChem (CID 62551750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).