6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide

C16H18N4O3S — CID 129053937

IUPAC6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCNS(=O)(=O)c1cnc2ccc(-c3cc(C)c(=O)n(C)c3)cn12
InChIInChI=1S/C16H18N4O3S/c1-4-18-24(22,23)15-8-17-14-6-5-12(10-20(14)15)13-7-11(2)16(21)19(3)9-13/h5-10,18H,4H2,1-3H3
InChIKeyXDJWORYIDMTBJY-UHFFFAOYSA-N
MW346.41 g/mol
LogP1.31
Rot. Bonds4

About 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide

6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 129053937) has the molecular formula C16H18N4O3S and a molecular weight of 346.41 g/mol. Its IUPAC name is 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID129053937
Molecular FormulaC16H18N4O3S
Molecular Weight346.41 g/mol
Exact Mass346.11
IUPAC Name6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCNS(=O)(=O)c1cnc2ccc(-c3cc(C)c(=O)n(C)c3)cn12
InChIInChI=1S/C16H18N4O3S/c1-4-18-24(22,23)15-8-17-14-6-5-12(10-20(14)15)13-7-11(2)16(21)19(3)9-13/h5-10,18H,4H2,1-3H3
InChIKeyXDJWORYIDMTBJY-UHFFFAOYSA-N
XLogP1.31
TPSA85.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide (CID 129053937) is 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide is CCNS(=O)(=O)c1cnc2ccc(-c3cc(C)c(=O)n(C)c3)cn12.
What is the InChIKey of 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is XDJWORYIDMTBJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3S/c1-4-18-24(22,23)15-8-17-14-6-5-12(10-20(14)15)13-7-11(2)16(21)19(3)9-13/h5-10,18H,4H2,1-3H3.
What are the key properties of 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide?
6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 346.41 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,5-dimethyl-6-oxo-3-pyridinyl)-N-ethylimidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 129053937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).