2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole

C20H15FN2O2 — CID 43913145

IUPAC2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole
SMILESCC(Oc1ccc2ccccc2c1)c1nnc(-c2ccc(F)cc2)o1
InChIInChI=1S/C20H15FN2O2/c1-13(24-18-11-8-14-4-2-3-5-16(14)12-18)19-22-23-20(25-19)15-6-9-17(21)10-7-15/h2-13H,1H3
InChIKeyAYCGDEPFODVCLQ-UHFFFAOYSA-N
MW334.35 g/mol
LogP5.17
Rot. Bonds4

About 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole

2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole (PubChem CID 43913145) has the molecular formula C20H15FN2O2 and a molecular weight of 334.35 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole
PubChem CID43913145
Molecular FormulaC20H15FN2O2
Molecular Weight334.35 g/mol
Exact Mass334.11
IUPAC Name2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole
SMILESCC(Oc1ccc2ccccc2c1)c1nnc(-c2ccc(F)cc2)o1
InChIInChI=1S/C20H15FN2O2/c1-13(24-18-11-8-14-4-2-3-5-16(14)12-18)19-22-23-20(25-19)15-6-9-17(21)10-7-15/h2-13H,1H3
InChIKeyAYCGDEPFODVCLQ-UHFFFAOYSA-N
XLogP5.17
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.35
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(4-chloro-3-methylphenoxy)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 15090951
2-(4-fluorophenyl)-5-[(1R)-1-(2-nitrophenoxy)ethyl]-1,3,4-oxadiazole
CID 9415745
[(1S)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] 1-hydroxynaphthalene-2-carboxylate
CID 8602918
[(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] naphthalene-2-carboxylate
CID 9416628
2-[[5-[(1S)-1-(4-fluorophenoxy)ethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-1-naphthalen-2-ylethanone
CID 41061621
[(1R)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] (E)-3-phenylprop-2-enoate
CID 9415384
[(1S)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-chlorobenzoate
CID 9412590
2-[1-(2-bromo-4-fluorophenoxy)ethyl]-5-(4-methylphenyl)-1,3,4-oxadiazole
CID 78812108
[(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 3-fluorobenzoate
CID 9198579
2-(4-chlorophenyl)-5-[1-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]oxyethyl]-1,3,4-oxadiazole
CID 22115704
2-[1-(4-fluorophenyl)sulfanylethyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 18201977
[(1S)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] 4-propan-2-ylbenzoate
CID 9417146

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole?
The IUPAC name of 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole (CID 43913145) is 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole is CC(Oc1ccc2ccccc2c1)c1nnc(-c2ccc(F)cc2)o1.
What is the InChIKey of 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole?
The InChIKey is AYCGDEPFODVCLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O2/c1-13(24-18-11-8-14-4-2-3-5-16(14)12-18)19-22-23-20(25-19)15-6-9-17(21)10-7-15/h2-13H,1H3.
What are the key properties of 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole?
2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole has a molecular weight of 334.35 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-(1-naphthalen-2-yloxyethyl)-1,3,4-oxadiazole is sourced from PubChem (CID 43913145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).