5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol

C14H10N4O2 — CID 91941700

IUPAC5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol
SMILESOc1cncc(C=Cc2nc(-c3ccncc3)no2)c1
InChIInChI=1S/C14H10N4O2/c19-12-7-10(8-16-9-12)1-2-13-17-14(18-20-13)11-3-5-15-6-4-11/h1-9,19H
InChIKeyYRGFFILEBHISJF-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.40
Rot. Bonds3

About 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol

5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol (PubChem CID 91941700) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol.

Molecular Properties

Compound Name5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol
PubChem CID91941700
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol
SMILESOc1cncc(C=Cc2nc(-c3ccncc3)no2)c1
InChIInChI=1S/C14H10N4O2/c19-12-7-10(8-16-9-12)1-2-13-17-14(18-20-13)11-3-5-15-6-4-11/h1-9,19H
InChIKeyYRGFFILEBHISJF-UHFFFAOYSA-N
XLogP2.40
TPSA84.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol?
The IUPAC name of 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol (CID 91941700) is 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol.
What is the SMILES notation for 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol?
The canonical SMILES for 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol is Oc1cncc(C=Cc2nc(-c3ccncc3)no2)c1.
What is the InChIKey of 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol?
The InChIKey is YRGFFILEBHISJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c19-12-7-10(8-16-9-12)1-2-13-17-14(18-20-13)11-3-5-15-6-4-11/h1-9,19H.
What are the key properties of 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol?
5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol has a molecular weight of 266.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)ethenyl]pyridin-3-ol is sourced from PubChem (CID 91941700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).