5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one

C11H8FNO2S — CID 135386760

IUPAC5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one
SMILESO=c1[nH]cc(Sc2cccc(F)c2)cc1O
InChIInChI=1S/C11H8FNO2S/c12-7-2-1-3-8(4-7)16-9-5-10(14)11(15)13-6-9/h1-6,14H,(H,13,15)
InChIKeySGCOJUOHDJWXFQ-UHFFFAOYSA-N
MW237.25 g/mol
LogP2.37
Rot. Bonds2

About 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one

5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one (PubChem CID 135386760) has the molecular formula C11H8FNO2S and a molecular weight of 237.25 g/mol. Its IUPAC name is 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one
PubChem CID135386760
Molecular FormulaC11H8FNO2S
Molecular Weight237.25 g/mol
Exact Mass237.03
IUPAC Name5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one
SMILESO=c1[nH]cc(Sc2cccc(F)c2)cc1O
InChIInChI=1S/C11H8FNO2S/c12-7-2-1-3-8(4-7)16-9-5-10(14)11(15)13-6-9/h1-6,14H,(H,13,15)
InChIKeySGCOJUOHDJWXFQ-UHFFFAOYSA-N
XLogP2.37
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one?
The IUPAC name of 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one (CID 135386760) is 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one.
What is the SMILES notation for 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one?
The canonical SMILES for 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one is O=c1[nH]cc(Sc2cccc(F)c2)cc1O.
What is the InChIKey of 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one?
The InChIKey is SGCOJUOHDJWXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FNO2S/c12-7-2-1-3-8(4-7)16-9-5-10(14)11(15)13-6-9/h1-6,14H,(H,13,15).
What are the key properties of 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one?
5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one has a molecular weight of 237.25 g/mol, XLogP of 2.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)sulfanyl-3-hydroxy-1H-pyridin-2-one is sourced from PubChem (CID 135386760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).