3-pyrazin-2-yl-1,2,4-oxadiazole

C6H4N4O — CID 3062315

IUPAC3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESc1cnc(-c2ncon2)cn1
InChIInChI=1S/C6H4N4O/c1-2-8-5(3-7-1)6-9-4-11-10-6/h1-4H
InChIKeyUMLFDKVERILJEA-UHFFFAOYSA-N
MW148.12 g/mol
LogP0.53
Rot. Bonds1

About 3-pyrazin-2-yl-1,2,4-oxadiazole

3-pyrazin-2-yl-1,2,4-oxadiazole (PubChem CID 3062315) has the molecular formula C6H4N4O and a molecular weight of 148.12 g/mol. Its IUPAC name is 3-pyrazin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-pyrazin-2-yl-1,2,4-oxadiazole
PubChem CID3062315
Molecular FormulaC6H4N4O
Molecular Weight148.12 g/mol
Exact Mass148.04
IUPAC Name3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESc1cnc(-c2ncon2)cn1
InChIInChI=1S/C6H4N4O/c1-2-8-5(3-7-1)6-9-4-11-10-6/h1-4H
InChIKeyUMLFDKVERILJEA-UHFFFAOYSA-N
XLogP0.53
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.12
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-Pyrazinyl)-1,2,4-oxadiazole-5-ethanamine hydrochloride (1:1)
CID 46737066
3-Pyrazin-2-yl-5-(trifluoromethyl)-1,2,4-oxadiazole
CID 89585093
5-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)pyrazin-2-amine
CID 89601194
3-(6-Fluoro-2-pyrazinyl)-1,2,4-oxadiazole
CID 176458934
3-(Pyrazin-2-yl)-1,2,4-oxadiazole-5-carboxamide
CID 49670417
3-(3-Chloropyrazin-2-yl)-5-methyl-1,2,4-oxadiazole
CID 12848155
5-Methyl-3-(pyrazin-2-yl)-1,2,4-oxadiazole
CID 13715707
2-(5-Chloromethyl-[1,2,4]oxadiazol-3-YL)-pyrazine
CID 13715711
5-Ethyl-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 21560762
5-Cyclopropyl-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 21560763
(3-(Pyrazin-2-yl)-1,2,4-oxadiazol-5-yl)methanamine
CID 43807287
5-Tert-butyl-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 59019222

Frequently Asked Questions

What is the IUPAC name of 3-pyrazin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 3-pyrazin-2-yl-1,2,4-oxadiazole (CID 3062315) is 3-pyrazin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 3-pyrazin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 3-pyrazin-2-yl-1,2,4-oxadiazole is c1cnc(-c2ncon2)cn1.
What is the InChIKey of 3-pyrazin-2-yl-1,2,4-oxadiazole?
The InChIKey is UMLFDKVERILJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4O/c1-2-8-5(3-7-1)6-9-4-11-10-6/h1-4H.
What are the key properties of 3-pyrazin-2-yl-1,2,4-oxadiazole?
3-pyrazin-2-yl-1,2,4-oxadiazole has a molecular weight of 148.12 g/mol, XLogP of 0.53, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 3062315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).