3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole

C13H9N3O — CID 69178344

IUPAC3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole
SMILESc1ccc(-c2cncc(-c3ncon3)c2)cc1
InChIInChI=1S/C13H9N3O/c1-2-4-10(5-3-1)11-6-12(8-14-7-11)13-15-9-17-16-13/h1-9H
InChIKeyKNCMKDOUUPKAHT-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.80
Rot. Bonds2

About 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole

3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole (PubChem CID 69178344) has the molecular formula C13H9N3O and a molecular weight of 223.24 g/mol. Its IUPAC name is 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole
PubChem CID69178344
Molecular FormulaC13H9N3O
Molecular Weight223.24 g/mol
Exact Mass223.07
IUPAC Name3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole
SMILESc1ccc(-c2cncc(-c3ncon3)c2)cc1
InChIInChI=1S/C13H9N3O/c1-2-4-10(5-3-1)11-6-12(8-14-7-11)13-15-9-17-16-13/h1-9H
InChIKeyKNCMKDOUUPKAHT-UHFFFAOYSA-N
XLogP2.80
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-phenyl-5-[10-(5-phenyl-3-pyridinyl)anthracen-9-yl]pyridine
CID 88908908
(2E)-N,2-dimethyl-4-[5-(1,2,4-oxadiazol-3-yl)-3-pyridinyl]-N-phenylpenta-2,4-dienamide
CID 88587861
[3-(1,2,4-oxadiazol-3-yl)phenyl]boronic acid
CID 54772334
[3-(1,2,4-oxadiazol-3-yl)phenyl]methanol
CID 134817586
5-phenylpyridin-3-ol
CID 2762902
4-(1,2,4-oxadiazol-3-yl)benzene-1,2-diamine
CID 67440607
(5-phenyl-3-pyridinyl)borinic acid
CID 143745833
3-[3-[3-[3-phenyl-5-[3-[3-(5-pyridin-3-yl-3-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-5-pyridin-3-ylpyridine
CID 155116854
N-[[3-(1,2,4-oxadiazol-3-yl)phenyl]methylideneamino]aniline
CID 169382687
3-(1,2,4-oxadiazol-3-yl)benzenesulfinic acid
CID 68526616
5-phenyl-N-(5-phenyl-3-pyridinyl)pyridin-3-amine
CID 146533965
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
CID 59724442

Frequently Asked Questions

What is the IUPAC name of 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole?
The IUPAC name of 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole (CID 69178344) is 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole.
What is the SMILES notation for 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole?
The canonical SMILES for 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole is c1ccc(-c2cncc(-c3ncon3)c2)cc1.
What is the InChIKey of 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole?
The InChIKey is KNCMKDOUUPKAHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O/c1-2-4-10(5-3-1)11-6-12(8-14-7-11)13-15-9-17-16-13/h1-9H.
What are the key properties of 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole?
3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole has a molecular weight of 223.24 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole is sourced from PubChem (CID 69178344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).