1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide

C9H11N3O2S — CID 165442818

IUPAC1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide
SMILESCNS(=O)(=O)Cc1cn2ccccc2n1
InChIInChI=1S/C9H11N3O2S/c1-10-15(13,14)7-8-6-12-5-3-2-4-9(12)11-8/h2-6,10H,7H2,1H3
InChIKeyDEIBKWKTPJPHQU-UHFFFAOYSA-N
MW225.27 g/mol
LogP0.38
Rot. Bonds3

About 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide

1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide (PubChem CID 165442818) has the molecular formula C9H11N3O2S and a molecular weight of 225.27 g/mol. Its IUPAC name is 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide.

Molecular Properties

Compound Name1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide
PubChem CID165442818
Molecular FormulaC9H11N3O2S
Molecular Weight225.27 g/mol
Exact Mass225.06
IUPAC Name1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide
SMILESCNS(=O)(=O)Cc1cn2ccccc2n1
InChIInChI=1S/C9H11N3O2S/c1-10-15(13,14)7-8-6-12-5-3-2-4-9(12)11-8/h2-6,10H,7H2,1H3
InChIKeyDEIBKWKTPJPHQU-UHFFFAOYSA-N
XLogP0.38
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide?
The IUPAC name of 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide (CID 165442818) is 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide.
What is the SMILES notation for 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide?
The canonical SMILES for 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide is CNS(=O)(=O)Cc1cn2ccccc2n1.
What is the InChIKey of 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide?
The InChIKey is DEIBKWKTPJPHQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S/c1-10-15(13,14)7-8-6-12-5-3-2-4-9(12)11-8/h2-6,10H,7H2,1H3.
What are the key properties of 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide?
1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide has a molecular weight of 225.27 g/mol, XLogP of 0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[1,2-a]pyridin-2-yl-N-methylmethanesulfonamide is sourced from PubChem (CID 165442818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).