5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole

C11H9N5O2 — CID 100642458

IUPAC5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESCCc1ocnc1-c1nc(-c2cnccn2)no1
InChIInChI=1S/C11H9N5O2/c1-2-8-9(14-6-17-8)11-15-10(16-18-11)7-5-12-3-4-13-7/h3-6H,2H2,1H3
InChIKeyIYNBTVNZCHRTAC-UHFFFAOYSA-N
MW243.23 g/mol
LogP1.74
Rot. Bonds3

About 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole

5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole (PubChem CID 100642458) has the molecular formula C11H9N5O2 and a molecular weight of 243.23 g/mol. Its IUPAC name is 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
PubChem CID100642458
Molecular FormulaC11H9N5O2
Molecular Weight243.23 g/mol
Exact Mass243.08
IUPAC Name5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESCCc1ocnc1-c1nc(-c2cnccn2)no1
InChIInChI=1S/C11H9N5O2/c1-2-8-9(14-6-17-8)11-15-10(16-18-11)7-5-12-3-4-13-7/h3-6H,2H2,1H3
InChIKeyIYNBTVNZCHRTAC-UHFFFAOYSA-N
XLogP1.74
TPSA90.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.23
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole (CID 100642458) is 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole is CCc1ocnc1-c1nc(-c2cnccn2)no1.
What is the InChIKey of 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole?
The InChIKey is IYNBTVNZCHRTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O2/c1-2-8-9(14-6-17-8)11-15-10(16-18-11)7-5-12-3-4-13-7/h3-6H,2H2,1H3.
What are the key properties of 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole?
5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole has a molecular weight of 243.23 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethyl-1,3-oxazol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 100642458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).