4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole

C9H5N5O2 — CID 67801372

IUPAC4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole
SMILESc1cc(-c2conn2)ncc1-c1conn1
InChIInChI=1S/C9H5N5O2/c1-2-7(9-5-16-14-12-9)10-3-6(1)8-4-15-13-11-8/h1-5H
InChIKeyDRKQAFWZDSRFSL-UHFFFAOYSA-N
MW215.17 g/mol
LogP1.18
Rot. Bonds2

About 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole

4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole (PubChem CID 67801372) has the molecular formula C9H5N5O2 and a molecular weight of 215.17 g/mol. Its IUPAC name is 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole.

Molecular Properties

Compound Name4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole
PubChem CID67801372
Molecular FormulaC9H5N5O2
Molecular Weight215.17 g/mol
Exact Mass215.04
IUPAC Name4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole
SMILESc1cc(-c2conn2)ncc1-c1conn1
InChIInChI=1S/C9H5N5O2/c1-2-7(9-5-16-14-12-9)10-3-6(1)8-4-15-13-11-8/h1-5H
InChIKeyDRKQAFWZDSRFSL-UHFFFAOYSA-N
XLogP1.18
TPSA90.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.17
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole?
The IUPAC name of 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole (CID 67801372) is 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole.
What is the SMILES notation for 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole?
The canonical SMILES for 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole is c1cc(-c2conn2)ncc1-c1conn1.
What is the InChIKey of 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole?
The InChIKey is DRKQAFWZDSRFSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5N5O2/c1-2-7(9-5-16-14-12-9)10-3-6(1)8-4-15-13-11-8/h1-5H.
What are the key properties of 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole?
4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole has a molecular weight of 215.17 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(oxadiazol-4-yl)-2-pyridinyl]oxadiazole is sourced from PubChem (CID 67801372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).