4-(2,2-diphenylethylidene)oxadiazole

C16H14N2O — CID 174510452

IUPAC4-(2,2-diphenylethylidene)oxadiazole
SMILESC(=C1CON=N1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14N2O/c1-3-7-13(8-4-1)16(11-15-12-19-18-17-15)14-9-5-2-6-10-14/h1-11,16H,12H2
InChIKeyCWNHMRZJPCGIBL-UHFFFAOYSA-N
MW250.30 g/mol
LogP4.10
Rot. Bonds3

About 4-(2,2-diphenylethylidene)oxadiazole

4-(2,2-diphenylethylidene)oxadiazole (PubChem CID 174510452) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(2,2-diphenylethylidene)oxadiazole.

Molecular Properties

Compound Name4-(2,2-diphenylethylidene)oxadiazole
PubChem CID174510452
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name4-(2,2-diphenylethylidene)oxadiazole
SMILESC(=C1CON=N1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14N2O/c1-3-7-13(8-4-1)16(11-15-12-19-18-17-15)14-9-5-2-6-10-14/h1-11,16H,12H2
InChIKeyCWNHMRZJPCGIBL-UHFFFAOYSA-N
XLogP4.10
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-bis(2,2-diphenylethylidene)oxadiazole
CID 175290942
(1S)-1-phenyl-2-(1,3-thiazol-4-ylidene)ethanamine
CID 67715926
2-(2,6-dimethyl-4-pyridinyl)-2-phenylacetaldehyde
CID 87096774
1,1-diphenyl-N-trimethylsilylmethanamine
CID 14203894
benzhydrylalumane
CID 146889225
dichlororuthenium;1-phenylprop-2-enylbenzene
CID 175974276
1,1-diphenylbut-3-en-2-ol
CID 88826241
barium(2+);bis(1,3-diphenylprop-2-enylbenzene)
CID 154250998
4,4-diphenylbut-2-enal
CID 154401916
2-(2-methylphenyl)-2-phenylacetaldehyde
CID 76507098
2-(3,5-difluorophenyl)-2-phenylacetaldehyde
CID 87253871
CID 88515342
CID 88515342

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-diphenylethylidene)oxadiazole?
The IUPAC name of 4-(2,2-diphenylethylidene)oxadiazole (CID 174510452) is 4-(2,2-diphenylethylidene)oxadiazole.
What is the SMILES notation for 4-(2,2-diphenylethylidene)oxadiazole?
The canonical SMILES for 4-(2,2-diphenylethylidene)oxadiazole is C(=C1CON=N1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-(2,2-diphenylethylidene)oxadiazole?
The InChIKey is CWNHMRZJPCGIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-3-7-13(8-4-1)16(11-15-12-19-18-17-15)14-9-5-2-6-10-14/h1-11,16H,12H2.
What are the key properties of 4-(2,2-diphenylethylidene)oxadiazole?
4-(2,2-diphenylethylidene)oxadiazole has a molecular weight of 250.30 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-diphenylethylidene)oxadiazole is sourced from PubChem (CID 174510452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).