4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole

C11H7N3OS — CID 73439763

IUPAC4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole
SMILESc1csc(-c2oncc2-c2cnccn2)c1
InChIInChI=1S/C11H7N3OS/c1-2-10(16-5-1)11-8(6-14-15-11)9-7-12-3-4-13-9/h1-7H
InChIKeyRCIATWIFOMKKJA-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.86
Rot. Bonds2

About 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole

4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole (PubChem CID 73439763) has the molecular formula C11H7N3OS and a molecular weight of 229.26 g/mol. Its IUPAC name is 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole.

Molecular Properties

Compound Name4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole
PubChem CID73439763
Molecular FormulaC11H7N3OS
Molecular Weight229.26 g/mol
Exact Mass229.03
IUPAC Name4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole
SMILESc1csc(-c2oncc2-c2cnccn2)c1
InChIInChI=1S/C11H7N3OS/c1-2-10(16-5-1)11-8(6-14-15-11)9-7-12-3-4-13-9/h1-7H
InChIKeyRCIATWIFOMKKJA-UHFFFAOYSA-N
XLogP2.86
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole?
The IUPAC name of 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole (CID 73439763) is 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole.
What is the SMILES notation for 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole?
The canonical SMILES for 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole is c1csc(-c2oncc2-c2cnccn2)c1.
What is the InChIKey of 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole?
The InChIKey is RCIATWIFOMKKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3OS/c1-2-10(16-5-1)11-8(6-14-15-11)9-7-12-3-4-13-9/h1-7H.
What are the key properties of 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole?
4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole has a molecular weight of 229.26 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrazin-2-yl-5-thiophen-2-yl-1,2-oxazole is sourced from PubChem (CID 73439763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).