2,4,5-triphenyl-5H-oxadiazole

C20H16N2O — CID 123432750

IUPAC2,4,5-triphenyl-5H-oxadiazole
SMILESc1ccc(C2=NN(c3ccccc3)OC2c2ccccc2)cc1
InChIInChI=1S/C20H16N2O/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-22(21-19)18-14-8-3-9-15-18/h1-15,20H
InChIKeyOAFKZUDMCGHFDT-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.58
Rot. Bonds3

About 2,4,5-triphenyl-5H-oxadiazole

2,4,5-triphenyl-5H-oxadiazole (PubChem CID 123432750) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 2,4,5-triphenyl-5H-oxadiazole.

Molecular Properties

Compound Name2,4,5-triphenyl-5H-oxadiazole
PubChem CID123432750
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name2,4,5-triphenyl-5H-oxadiazole
SMILESc1ccc(C2=NN(c3ccccc3)OC2c2ccccc2)cc1
InChIInChI=1S/C20H16N2O/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-22(21-19)18-14-8-3-9-15-18/h1-15,20H
InChIKeyOAFKZUDMCGHFDT-UHFFFAOYSA-N
XLogP4.58
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 12996356
3,5,7-triphenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one
CID 12658911
(1S,4R)-1,3,4,5,7-pentakis-phenyl-1,4-dihydrofuro[3,4-d]oxazine
CID 102041983
(2S,5S,6R)-2,4,6-triphenyl-1,3-diazabicyclo[3.1.0]hex-3-ene
CID 7230464
(1S,4S,5S,6R,7S)-2,4,5,7-tetraphenyl-3-azabicyclo[4.1.0]hept-2-ene
CID 100886473
2,3,5-triphenyl-2H-1,3,4-thiadiazole 1-oxide
CID 21332491
(5aS,6S)-5,6,7-triphenyl-2,3,5a,6-tetrahydropyrrolo[3,4-e][1,4]diazepin-8-one
CID 7412044
(2R,3R,4'R)-1',2,3',4'-tetraphenylspiro[2H-chromene-3,5'-4H-pyrazole]-4-one
CID 139056858
1',3',4'-triphenylspiro[2H-chromene-3,5'-4H-pyrazole]-4-one
CID 101174871
(5S)-2-(3-methylbut-2-enyl)-4-phenyl-5H-oxadiazol-5-ol
CID 825336
3-phenyl-2-pyridin-3-yloxaziridine
CID 19026281
(4S,5S)-1,2,4,5-tetraphenyl-4,5-dihydroimidazole
CID 139040757

Frequently Asked Questions

What is the IUPAC name of 2,4,5-triphenyl-5H-oxadiazole?
The IUPAC name of 2,4,5-triphenyl-5H-oxadiazole (CID 123432750) is 2,4,5-triphenyl-5H-oxadiazole.
What is the SMILES notation for 2,4,5-triphenyl-5H-oxadiazole?
The canonical SMILES for 2,4,5-triphenyl-5H-oxadiazole is c1ccc(C2=NN(c3ccccc3)OC2c2ccccc2)cc1.
What is the InChIKey of 2,4,5-triphenyl-5H-oxadiazole?
The InChIKey is OAFKZUDMCGHFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-22(21-19)18-14-8-3-9-15-18/h1-15,20H.
What are the key properties of 2,4,5-triphenyl-5H-oxadiazole?
2,4,5-triphenyl-5H-oxadiazole has a molecular weight of 300.36 g/mol, XLogP of 4.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-triphenyl-5H-oxadiazole is sourced from PubChem (CID 123432750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).