(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol

C16H12N2O2 — CID 135698723

IUPAC(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol
SMILESO/C(=C\c1nc(-c2ccccc2)no1)c1ccccc1
InChIInChI=1S/C16H12N2O2/c19-14(12-7-3-1-4-8-12)11-15-17-16(18-20-15)13-9-5-2-6-10-13/h1-11,19H/b14-11-
InChIKeyXBBODAYCXLFTEU-KAMYIIQDSA-N
MW264.28 g/mol
LogP3.79
Rot. Bonds3

About (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol

(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol (PubChem CID 135698723) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol.

Molecular Properties

Compound Name(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol
PubChem CID135698723
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol
SMILESO/C(=C\c1nc(-c2ccccc2)no1)c1ccccc1
InChIInChI=1S/C16H12N2O2/c19-14(12-7-3-1-4-8-12)11-15-17-16(18-20-15)13-9-5-2-6-10-13/h1-11,19H/b14-11-
InChIKeyXBBODAYCXLFTEU-KAMYIIQDSA-N
XLogP3.79
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole
CID 9038019
4-[5-[(E)-2-phenylethenyl]-1,2,4-oxadiazol-3-yl]aniline
CID 133064436
(1S)-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanol
CID 66264576
2-(3-phenyl-1,2,4-oxadiazol-5-yl)acetic acid
CID 7017713
4-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)pentan-2-ol
CID 63345406
2-[3-(2-hydroxy-2-phenylethenyl)quinoxalin-2-yl]-1-phenylethenol
CID 507219
3-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-2-ol
CID 63345367
5-benzyl-3-phenyl-1,2,4-oxadiazole
CID 752274
4-[(Z)-2-chloro-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenyl]-2,6-dimethylphenol
CID 135574248
2-[6-[6-(2-hydroxy-2-phenylethenyl)-2-pyridinyl]-2-pyridinyl]-1-phenylethenol
CID 157160234
1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)propan-1-ol
CID 104847315
5-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)ethenyl]-3-phenyl-1,2,4-oxadiazole
CID 9038059

Frequently Asked Questions

What is the IUPAC name of (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol?
The IUPAC name of (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol (CID 135698723) is (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol.
What is the SMILES notation for (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol?
The canonical SMILES for (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol is O/C(=C\c1nc(-c2ccccc2)no1)c1ccccc1.
What is the InChIKey of (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol?
The InChIKey is XBBODAYCXLFTEU-KAMYIIQDSA-N. The full InChI is InChI=1S/C16H12N2O2/c19-14(12-7-3-1-4-8-12)11-15-17-16(18-20-15)13-9-5-2-6-10-13/h1-11,19H/b14-11-.
What are the key properties of (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol?
(Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol has a molecular weight of 264.28 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-phenyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenol is sourced from PubChem (CID 135698723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).