2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide

C9H11N3O2S2 — CID 14422447

IUPAC2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCSc1nc2ccccn2c1S(N)(=O)=O
InChIInChI=1S/C9H11N3O2S2/c1-2-15-8-9(16(10,13)14)12-6-4-3-5-7(12)11-8/h3-6H,2H2,1H3,(H2,10,13,14)
InChIKeyFPJRBSCZMAJEEE-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.09
Rot. Bonds3

About 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide

2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 14422447) has the molecular formula C9H11N3O2S2 and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID14422447
Molecular FormulaC9H11N3O2S2
Molecular Weight257.34 g/mol
Exact Mass257.03
IUPAC Name2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCSc1nc2ccccn2c1S(N)(=O)=O
InChIInChI=1S/C9H11N3O2S2/c1-2-15-8-9(16(10,13)14)12-6-4-3-5-7(12)11-8/h3-6H,2H2,1H3,(H2,10,13,14)
InChIKeyFPJRBSCZMAJEEE-UHFFFAOYSA-N
XLogP1.09
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide (CID 14422447) is 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide is CCSc1nc2ccccn2c1S(N)(=O)=O.
What is the InChIKey of 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is FPJRBSCZMAJEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S2/c1-2-15-8-9(16(10,13)14)12-6-4-3-5-7(12)11-8/h3-6H,2H2,1H3,(H2,10,13,14).
What are the key properties of 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide?
2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 257.34 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfanylimidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 14422447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).