1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one

C19H15FN4O2 — CID 22268178

IUPAC1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one
SMILESO=C(CN1CCn2c1nc(-c1ccncc1)cc2=O)c1ccc(F)cc1
InChIInChI=1S/C19H15FN4O2/c20-15-3-1-14(2-4-15)17(25)12-23-9-10-24-18(26)11-16(22-19(23)24)13-5-7-21-8-6-13/h1-8,11H,9-10,12H2
InChIKeyGKUFURGTPTUCEA-UHFFFAOYSA-N
MW350.35 g/mol
LogP2.15
Rot. Bonds4

About 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one

1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one (PubChem CID 22268178) has the molecular formula C19H15FN4O2 and a molecular weight of 350.35 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one
PubChem CID22268178
Molecular FormulaC19H15FN4O2
Molecular Weight350.35 g/mol
Exact Mass350.12
IUPAC Name1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one
SMILESO=C(CN1CCn2c1nc(-c1ccncc1)cc2=O)c1ccc(F)cc1
InChIInChI=1S/C19H15FN4O2/c20-15-3-1-14(2-4-15)17(25)12-23-9-10-24-18(26)11-16(22-19(23)24)13-5-7-21-8-6-13/h1-8,11H,9-10,12H2
InChIKeyGKUFURGTPTUCEA-UHFFFAOYSA-N
XLogP2.15
TPSA68.09 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2,5-dioxo-1-(pyridin-3-ylmethyl)-4-(trifluoromethyl)imidazolidin-4-yl]-4-fluorobenzamide
CID 4325939
4-Aza-8-fluorotryptanthrin
CID 478671
2-[[2-(3-Fluorophenyl)-2-oxoethyl]amino]-3-methyl-6-pyridin-4-ylpyrimidin-4-one
CID 9880962
3-Methyl-2-[[2-(3-methylphenyl)-2-oxoethyl]amino]-6-pyridin-4-ylpyrimidin-4-one
CID 9923750
2-[[2-(4-Fluorophenyl)-2-oxoethyl]amino]-3-methyl-6-pyridin-4-ylpyrimidin-4-one
CID 10131935
3-methyl-2-(2-oxo-2-phenylethylamino)-6-pyridin-4-yl-3H-pyrimidin-4-one
CID 10308589
2-[[2-(3-Chlorophenyl)-2-oxoethyl]amino]-3-methyl-6-pyridin-4-ylpyrimidin-4-one
CID 10309005
3-[3-[(2-Fluoro-4-pyridyl)methyl]-5-isopropyl-2,6-dioxo-pyrimidine-4-carbonyl]-5-methyl-benzonitrile
CID 25028292
1-[5-(4-Acetylpiperazin-1-yl)-3-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrrol-2-yl]ethanone
CID 44419815
2-[[2-(2-Fluorophenyl)-2-oxoethyl]amino]-3-methyl-6-pyridin-4-ylpyrimidin-4-one
CID 59793866
3-[2-[(1-Methyl-6-oxo-4-pyridin-4-ylpyrimidin-2-yl)amino]acetyl]benzonitrile
CID 59793933
N-[[(2S)-1-[(2S)-3-methyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-2,3-dihydropyrrolo[2,3-b]pyridin-2-yl]methyl]benzamide
CID 76902766

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one (CID 22268178) is 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one is O=C(CN1CCn2c1nc(-c1ccncc1)cc2=O)c1ccc(F)cc1.
What is the InChIKey of 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
The InChIKey is GKUFURGTPTUCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2/c20-15-3-1-14(2-4-15)17(25)12-23-9-10-24-18(26)11-16(22-19(23)24)13-5-7-21-8-6-13/h1-8,11H,9-10,12H2.
What are the key properties of 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one?
1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one has a molecular weight of 350.35 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)-2-oxoethyl]-7-pyridin-4-yl-2,3-dihydroimidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 22268178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).