2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol

C10H9FN2O2 — CID 115080371

IUPAC2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol
SMILESOCCc1nc(-c2ccccc2F)no1
InChIInChI=1S/C10H9FN2O2/c11-8-4-2-1-3-7(8)10-12-9(5-6-14)15-13-10/h1-4,14H,5-6H2
InChIKeyJLOUDROSCMSZPA-UHFFFAOYSA-N
MW208.19 g/mol
LogP1.41
Rot. Bonds3

About 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol

2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol (PubChem CID 115080371) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol.

Molecular Properties

Compound Name2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol
PubChem CID115080371
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol
SMILESOCCc1nc(-c2ccccc2F)no1
InChIInChI=1S/C10H9FN2O2/c11-8-4-2-1-3-7(8)10-12-9(5-6-14)15-13-10/h1-4,14H,5-6H2
InChIKeyJLOUDROSCMSZPA-UHFFFAOYSA-N
XLogP1.41
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-3-(2-fluorophenyl)-1,2,4-oxadiazole
CID 129238942
2-[3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]ethanol
CID 115080368
2-fluoro-N-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]benzamide
CID 110323403
N-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]cyclopropanamine
CID 62716288
1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]propan-2-amine
CID 62715597
N-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-4-methylbenzamide
CID 110323402
N-benzyl-3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 110330717
N-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-4-(trifluoromethyl)benzamide
CID 110323445
N-[[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]propan-2-amine
CID 62716626
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(2-methylphenyl)propanamide
CID 22431108
N-benzyl-3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
CID 110330721
4-fluoro-N-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]benzenesulfonamide
CID 110323465

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol?
The IUPAC name of 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol (CID 115080371) is 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol.
What is the SMILES notation for 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol?
The canonical SMILES for 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol is OCCc1nc(-c2ccccc2F)no1.
What is the InChIKey of 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol?
The InChIKey is JLOUDROSCMSZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c11-8-4-2-1-3-7(8)10-12-9(5-6-14)15-13-10/h1-4,14H,5-6H2.
What are the key properties of 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol?
2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol has a molecular weight of 208.19 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol is sourced from PubChem (CID 115080371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).