3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol

C10H10FNO2 — CID 59652532

IUPAC3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol
SMILESCC1(O)CC(c2ccc(F)cc2)=NO1
InChIInChI=1S/C10H10FNO2/c1-10(13)6-9(12-14-10)7-2-4-8(11)5-3-7/h2-5,13H,6H2,1H3
InChIKeyDSXOZIRLVJSUJF-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.66
Rot. Bonds1

About 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol

3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol (PubChem CID 59652532) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol.

Molecular Properties

Compound Name3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol
PubChem CID59652532
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol
SMILESCC1(O)CC(c2ccc(F)cc2)=NO1
InChIInChI=1S/C10H10FNO2/c1-10(13)6-9(12-14-10)7-2-4-8(11)5-3-7/h2-5,13H,6H2,1H3
InChIKeyDSXOZIRLVJSUJF-UHFFFAOYSA-N
XLogP1.66
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol?
The IUPAC name of 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol (CID 59652532) is 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol.
What is the SMILES notation for 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol?
The canonical SMILES for 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol is CC1(O)CC(c2ccc(F)cc2)=NO1.
What is the InChIKey of 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol?
The InChIKey is DSXOZIRLVJSUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c1-10(13)6-9(12-14-10)7-2-4-8(11)5-3-7/h2-5,13H,6H2,1H3.
What are the key properties of 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol?
3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol has a molecular weight of 195.19 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-5-methyl-4H-1,2-oxazol-5-ol is sourced from PubChem (CID 59652532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).