2-methylsulfanylimidazo[1,2-a]pyridine

C8H8N2S — CID 14045444

IUPAC2-methylsulfanylimidazo[1,2-a]pyridine
SMILESCSc1cn2ccccc2n1
InChIInChI=1S/C8H8N2S/c1-11-8-6-10-5-3-2-4-7(10)9-8/h2-6H,1H3
InChIKeyXBLRBOZCKRRTBX-UHFFFAOYSA-N
MW164.23 g/mol
LogP2.06
Rot. Bonds1

About 2-methylsulfanylimidazo[1,2-a]pyridine

2-methylsulfanylimidazo[1,2-a]pyridine (PubChem CID 14045444) has the molecular formula C8H8N2S and a molecular weight of 164.23 g/mol. Its IUPAC name is 2-methylsulfanylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-methylsulfanylimidazo[1,2-a]pyridine
PubChem CID14045444
Molecular FormulaC8H8N2S
Molecular Weight164.23 g/mol
Exact Mass164.04
IUPAC Name2-methylsulfanylimidazo[1,2-a]pyridine
SMILESCSc1cn2ccccc2n1
InChIInChI=1S/C8H8N2S/c1-11-8-6-10-5-3-2-4-7(10)9-8/h2-6H,1H3
InChIKeyXBLRBOZCKRRTBX-UHFFFAOYSA-N
XLogP2.06
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylsulfanylimidazo[1,2-a]pyridine?
The IUPAC name of 2-methylsulfanylimidazo[1,2-a]pyridine (CID 14045444) is 2-methylsulfanylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-methylsulfanylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-methylsulfanylimidazo[1,2-a]pyridine is CSc1cn2ccccc2n1.
What is the InChIKey of 2-methylsulfanylimidazo[1,2-a]pyridine?
The InChIKey is XBLRBOZCKRRTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S/c1-11-8-6-10-5-3-2-4-7(10)9-8/h2-6H,1H3.
What are the key properties of 2-methylsulfanylimidazo[1,2-a]pyridine?
2-methylsulfanylimidazo[1,2-a]pyridine has a molecular weight of 164.23 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfanylimidazo[1,2-a]pyridine is sourced from PubChem (CID 14045444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).