5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole

C13H8ClN3O — CID 650707

IUPAC5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESClc1cccc(-c2nc(-c3ccccn3)no2)c1
InChIInChI=1S/C13H8ClN3O/c14-10-5-3-4-9(8-10)13-16-12(17-18-13)11-6-1-2-7-15-11/h1-8H
InChIKeyIMLLSKDXLVDFRH-UHFFFAOYSA-N
MW257.68 g/mol
LogP3.45
Rot. Bonds2

About 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole

5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole (PubChem CID 650707) has the molecular formula C13H8ClN3O and a molecular weight of 257.68 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
PubChem CID650707
Molecular FormulaC13H8ClN3O
Molecular Weight257.68 g/mol
Exact Mass257.04
IUPAC Name5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESClc1cccc(-c2nc(-c3ccccn3)no2)c1
InChIInChI=1S/C13H8ClN3O/c14-10-5-3-4-9(8-10)13-16-12(17-18-13)11-6-1-2-7-15-11/h1-8H
InChIKeyIMLLSKDXLVDFRH-UHFFFAOYSA-N
XLogP3.45
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.68
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(3-chlorophenyl)-3-pyridin-2-yl-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

Pifexole
CID 65758
Azd-9272
CID 9838729
Azd6538
CID 9879103
VU0285683
CID 9816778
5-(4-Chlorophenyl)-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 2820879
3-(3-(Pyridin-2-yl)-1,2,4-oxadiazol-5-yl)benzonitrile
CID 10198810
NS9283
CID 11998180
2-[5-(4-Methylphenyl)-1,2,4-oxadiazol-3-yl]pyridine
CID 763882
4-[5-(4-Methylphenyl)-1,2,4-oxadiazol-3-yl]pyridine
CID 763855
5-(3-Nitrophenyl)-3-(2-pyridyl)-1,2,4-oxadiazole
CID 867096
2-(5-o-Tolyl-[1,2,4]oxadiazol-3-yl)-pyridine
CID 700561
5-Naphthalen-1-yl-3-pyridin-2-yl-1,2,4-oxadiazole
CID 757874

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole (CID 650707) is 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole is Clc1cccc(-c2nc(-c3ccccn3)no2)c1.
What is the InChIKey of 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The InChIKey is IMLLSKDXLVDFRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClN3O/c14-10-5-3-4-9(8-10)13-16-12(17-18-13)11-6-1-2-7-15-11/h1-8H.
What are the key properties of 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole?
5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole has a molecular weight of 257.68 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 650707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).