2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide

C14H16N6O2S — CID 136569915

IUPAC2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide
SMILESCn1c(NS(=O)(=O)c2ccnn2C2CCC2)nc2cccnc21
InChIInChI=1S/C14H16N6O2S/c1-19-13-11(6-3-8-15-13)17-14(19)18-23(21,22)12-7-9-16-20(12)10-4-2-5-10/h3,6-10H,2,4-5H2,1H3,(H,17,18)
InChIKeyWEMKEQUPFJQTSD-UHFFFAOYSA-N
MW332.39 g/mol
LogP1.69
Rot. Bonds4

About 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide

2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide (PubChem CID 136569915) has the molecular formula C14H16N6O2S and a molecular weight of 332.39 g/mol. Its IUPAC name is 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide.

Molecular Properties

Compound Name2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide
PubChem CID136569915
Molecular FormulaC14H16N6O2S
Molecular Weight332.39 g/mol
Exact Mass332.11
IUPAC Name2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide
SMILESCn1c(NS(=O)(=O)c2ccnn2C2CCC2)nc2cccnc21
InChIInChI=1S/C14H16N6O2S/c1-19-13-11(6-3-8-15-13)17-14(19)18-23(21,22)12-7-9-16-20(12)10-4-2-5-10/h3,6-10H,2,4-5H2,1H3,(H,17,18)
InChIKeyWEMKEQUPFJQTSD-UHFFFAOYSA-N
XLogP1.69
TPSA94.70 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide?
The IUPAC name of 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide (CID 136569915) is 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide.
What is the SMILES notation for 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide?
The canonical SMILES for 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide is Cn1c(NS(=O)(=O)c2ccnn2C2CCC2)nc2cccnc21.
What is the InChIKey of 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide?
The InChIKey is WEMKEQUPFJQTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O2S/c1-19-13-11(6-3-8-15-13)17-14(19)18-23(21,22)12-7-9-16-20(12)10-4-2-5-10/h3,6-10H,2,4-5H2,1H3,(H,17,18).
What are the key properties of 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide?
2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide has a molecular weight of 332.39 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrazole-3-sulfonamide is sourced from PubChem (CID 136569915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).