5-(5-methylthiophen-2-yl)-1,2-oxazole

C8H7NOS — CID 45099284

IUPAC5-(5-methylthiophen-2-yl)-1,2-oxazole
SMILESCc1ccc(-c2ccno2)s1
InChIInChI=1S/C8H7NOS/c1-6-2-3-8(11-6)7-4-5-9-10-7/h2-5H,1H3
InChIKeyZDPFRUDQPUUDEZ-UHFFFAOYSA-N
MW165.22 g/mol
LogP2.71
Rot. Bonds1

About 5-(5-methylthiophen-2-yl)-1,2-oxazole

5-(5-methylthiophen-2-yl)-1,2-oxazole (PubChem CID 45099284) has the molecular formula C8H7NOS and a molecular weight of 165.22 g/mol. Its IUPAC name is 5-(5-methylthiophen-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name5-(5-methylthiophen-2-yl)-1,2-oxazole
PubChem CID45099284
Molecular FormulaC8H7NOS
Molecular Weight165.22 g/mol
Exact Mass165.02
IUPAC Name5-(5-methylthiophen-2-yl)-1,2-oxazole
SMILESCc1ccc(-c2ccno2)s1
InChIInChI=1S/C8H7NOS/c1-6-2-3-8(11-6)7-4-5-9-10-7/h2-5H,1H3
InChIKeyZDPFRUDQPUUDEZ-UHFFFAOYSA-N
XLogP2.71
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methylthiophen-2-yl)-1,2-oxazole?
The IUPAC name of 5-(5-methylthiophen-2-yl)-1,2-oxazole (CID 45099284) is 5-(5-methylthiophen-2-yl)-1,2-oxazole.
What is the SMILES notation for 5-(5-methylthiophen-2-yl)-1,2-oxazole?
The canonical SMILES for 5-(5-methylthiophen-2-yl)-1,2-oxazole is Cc1ccc(-c2ccno2)s1.
What is the InChIKey of 5-(5-methylthiophen-2-yl)-1,2-oxazole?
The InChIKey is ZDPFRUDQPUUDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NOS/c1-6-2-3-8(11-6)7-4-5-9-10-7/h2-5H,1H3.
What are the key properties of 5-(5-methylthiophen-2-yl)-1,2-oxazole?
5-(5-methylthiophen-2-yl)-1,2-oxazole has a molecular weight of 165.22 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methylthiophen-2-yl)-1,2-oxazole is sourced from PubChem (CID 45099284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).