2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide

C17H19N3O3S — CID 110504322

IUPAC2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc2nccn2c1C
InChIInChI=1S/C17H19N3O3S/c1-11-9-15(23-4)16(10-12(11)2)24(21,22)19-14-5-6-17-18-7-8-20(17)13(14)3/h5-10,19H,1-4H3
InChIKeyQSXGIXXYTFHERB-UHFFFAOYSA-N
MW345.42 g/mol
LogP3.07
Rot. Bonds4

About 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide

2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide (PubChem CID 110504322) has the molecular formula C17H19N3O3S and a molecular weight of 345.42 g/mol. Its IUPAC name is 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide
PubChem CID110504322
Molecular FormulaC17H19N3O3S
Molecular Weight345.42 g/mol
Exact Mass345.11
IUPAC Name2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc2nccn2c1C
InChIInChI=1S/C17H19N3O3S/c1-11-9-15(23-4)16(10-12(11)2)24(21,22)19-14-5-6-17-18-7-8-20(17)13(14)3/h5-10,19H,1-4H3
InChIKeyQSXGIXXYTFHERB-UHFFFAOYSA-N
XLogP3.07
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide?
The IUPAC name of 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide (CID 110504322) is 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide.
What is the SMILES notation for 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide?
The canonical SMILES for 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide is COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc2nccn2c1C.
What is the InChIKey of 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide?
The InChIKey is QSXGIXXYTFHERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3S/c1-11-9-15(23-4)16(10-12(11)2)24(21,22)19-14-5-6-17-18-7-8-20(17)13(14)3/h5-10,19H,1-4H3.
What are the key properties of 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide?
2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide has a molecular weight of 345.42 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,5-dimethyl-N-(5-methylimidazo[1,2-a]pyridin-6-yl)benzenesulfonamide is sourced from PubChem (CID 110504322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).