2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one

C11H9FN2O2 — CID 63613257

IUPAC2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1cc(O)nc(Cc2ccccc2F)[nH]1
InChIInChI=1S/C11H9FN2O2/c12-8-4-2-1-3-7(8)5-9-13-10(15)6-11(16)14-9/h1-4,6H,5H2,(H2,13,14,15,16)
InChIKeyLHNPXZZZFIQFKL-UHFFFAOYSA-N
MW220.20 g/mol
LogP1.21
Rot. Bonds2

About 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one

2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one (PubChem CID 63613257) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one
PubChem CID63613257
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC Name2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1cc(O)nc(Cc2ccccc2F)[nH]1
InChIInChI=1S/C11H9FN2O2/c12-8-4-2-1-3-7(8)5-9-13-10(15)6-11(16)14-9/h1-4,6H,5H2,(H2,13,14,15,16)
InChIKeyLHNPXZZZFIQFKL-UHFFFAOYSA-N
XLogP1.21
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one?
The IUPAC name of 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one (CID 63613257) is 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one is O=c1cc(O)nc(Cc2ccccc2F)[nH]1.
What is the InChIKey of 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one?
The InChIKey is LHNPXZZZFIQFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O2/c12-8-4-2-1-3-7(8)5-9-13-10(15)6-11(16)14-9/h1-4,6H,5H2,(H2,13,14,15,16).
What are the key properties of 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one?
2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one has a molecular weight of 220.20 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one is sourced from PubChem (CID 63613257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).