1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one

C14H11BrFN3O — CID 126696843

IUPAC1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one
SMILESO=C1NC(c2ccccn2)CN1c1ccc(Br)c(F)c1
InChIInChI=1S/C14H11BrFN3O/c15-10-5-4-9(7-11(10)16)19-8-13(18-14(19)20)12-3-1-2-6-17-12/h1-7,13H,8H2,(H,18,20)
InChIKeyQIWBEIBSJPMZIZ-UHFFFAOYSA-N
MW336.16 g/mol
LogP3.25
Rot. Bonds2

About 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one

1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one (PubChem CID 126696843) has the molecular formula C14H11BrFN3O and a molecular weight of 336.16 g/mol. Its IUPAC name is 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one
PubChem CID126696843
Molecular FormulaC14H11BrFN3O
Molecular Weight336.16 g/mol
Exact Mass335.01
IUPAC Name1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one
SMILESO=C1NC(c2ccccn2)CN1c1ccc(Br)c(F)c1
InChIInChI=1S/C14H11BrFN3O/c15-10-5-4-9(7-11(10)16)19-8-13(18-14(19)20)12-3-1-2-6-17-12/h1-7,13H,8H2,(H,18,20)
InChIKeyQIWBEIBSJPMZIZ-UHFFFAOYSA-N
XLogP3.25
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.16
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-3-fluorophenyl)-3-methyl-4-pyridin-2-ylimidazolidin-2-one
CID 126696678
1-(4-bromo-3-fluorophenyl)-3-tert-butylsulfinyl-4-pyridin-2-ylimidazolidin-2-one;ethane
CID 145275618
3-bromo-1-(4-bromo-3-fluorophenyl)pyrrolidin-2-one
CID 65437036
1-(4-aminophenyl)-4-(2-bromophenyl)imidazolidin-2-one
CID 116979261
(4S)-1,4-diphenylimidazolidin-2-one
CID 163207794
1-(4-bromo-3-fluorophenyl)-2,4-diethyl-4,5-dihydroimidazole
CID 153296396
1-(2-amino-2-methylpropyl)-4-pyridin-2-ylimidazolidin-2-one
CID 116978518
(5S)-5-(aminomethyl)-3-(4-bromo-3-fluorophenyl)-1,3-oxazolidin-2-one
CID 44607680
5,7-difluoro-2-pyridin-2-yl-2,3-dihydro-1H-indole
CID 3637452
1-(4-bromo-3-fluorophenyl)-3-(3,4-difluorophenyl)pyrrolidin-2-one
CID 118368403
1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one
CID 82132304
1-(4-bromo-3-fluorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 65430330

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one?
The IUPAC name of 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one (CID 126696843) is 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one?
The canonical SMILES for 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one is O=C1NC(c2ccccn2)CN1c1ccc(Br)c(F)c1.
What is the InChIKey of 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one?
The InChIKey is QIWBEIBSJPMZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFN3O/c15-10-5-4-9(7-11(10)16)19-8-13(18-14(19)20)12-3-1-2-6-17-12/h1-7,13H,8H2,(H,18,20).
What are the key properties of 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one?
1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one has a molecular weight of 336.16 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-3-fluorophenyl)-4-pyridin-2-ylimidazolidin-2-one is sourced from PubChem (CID 126696843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).