6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one

C12H8FN3O2 — CID 68751690

IUPAC6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESO=c1[nH]c2nccn2c(O)c1-c1ccccc1F
InChIInChI=1S/C12H8FN3O2/c13-8-4-2-1-3-7(8)9-10(17)15-12-14-5-6-16(12)11(9)18/h1-6,18H,(H,14,15,17)
InChIKeyAEGYCLUTTUJQEX-UHFFFAOYSA-N
MW245.21 g/mol
LogP1.53
Rot. Bonds1

About 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one

6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one (PubChem CID 68751690) has the molecular formula C12H8FN3O2 and a molecular weight of 245.21 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one.

Molecular Properties

Compound Name6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
PubChem CID68751690
Molecular FormulaC12H8FN3O2
Molecular Weight245.21 g/mol
Exact Mass245.06
IUPAC Name6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESO=c1[nH]c2nccn2c(O)c1-c1ccccc1F
InChIInChI=1S/C12H8FN3O2/c13-8-4-2-1-3-7(8)9-10(17)15-12-14-5-6-16(12)11(9)18/h1-6,18H,(H,14,15,17)
InChIKeyAEGYCLUTTUJQEX-UHFFFAOYSA-N
XLogP1.53
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.21
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The IUPAC name of 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one (CID 68751690) is 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one.
What is the SMILES notation for 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The canonical SMILES for 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one is O=c1[nH]c2nccn2c(O)c1-c1ccccc1F.
What is the InChIKey of 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
The InChIKey is AEGYCLUTTUJQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3O2/c13-8-4-2-1-3-7(8)9-10(17)15-12-14-5-6-16(12)11(9)18/h1-6,18H,(H,14,15,17).
What are the key properties of 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one?
6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one has a molecular weight of 245.21 g/mol, XLogP of 1.53, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-5-hydroxy-8H-imidazo[1,2-a]pyrimidin-7-one is sourced from PubChem (CID 68751690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).