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

C12H8N4O2 — CID 59758744

IUPAC5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol
SMILESOc1cncc(-c2nc(-c3cccnc3)no2)c1
InChIInChI=1S/C12H8N4O2/c17-10-4-9(6-14-7-10)12-15-11(16-18-12)8-2-1-3-13-5-8/h1-7,17H
InChIKeyUTAIDNYAKXJGAZ-UHFFFAOYSA-N
MW240.22 g/mol
LogP1.90
Rot. Bonds2

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

5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol (PubChem CID 59758744) has the molecular formula C12H8N4O2 and a molecular weight of 240.22 g/mol. Its IUPAC name is 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol.

Molecular Properties

Compound Name5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol
PubChem CID59758744
Molecular FormulaC12H8N4O2
Molecular Weight240.22 g/mol
Exact Mass240.06
IUPAC Name5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol
SMILESOc1cncc(-c2nc(-c3cccnc3)no2)c1
InChIInChI=1S/C12H8N4O2/c17-10-4-9(6-14-7-10)12-15-11(16-18-12)8-2-1-3-13-5-8/h1-7,17H
InChIKeyUTAIDNYAKXJGAZ-UHFFFAOYSA-N
XLogP1.90
TPSA84.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol?
The IUPAC name of 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol (CID 59758744) is 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol.
What is the SMILES notation for 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol?
The canonical SMILES for 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol is Oc1cncc(-c2nc(-c3cccnc3)no2)c1.
What is the InChIKey of 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol?
The InChIKey is UTAIDNYAKXJGAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N4O2/c17-10-4-9(6-14-7-10)12-15-11(16-18-12)8-2-1-3-13-5-8/h1-7,17H.
What are the key properties of 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol?
5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol has a molecular weight of 240.22 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyridin-3-ol is sourced from PubChem (CID 59758744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).