N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide

C15H16N4O2S — CID 39344346

IUPACN-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
SMILESCC(C)n1ncc2cc(NS(=O)(=O)c3ccccc3)cnc21
InChIInChI=1S/C15H16N4O2S/c1-11(2)19-15-12(9-17-19)8-13(10-16-15)18-22(20,21)14-6-4-3-5-7-14/h3-11,18H,1-2H3
InChIKeyXBRAHVYJVIYGJS-UHFFFAOYSA-N
MW316.39 g/mol
LogP2.81
Rot. Bonds4

About N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide

N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide (PubChem CID 39344346) has the molecular formula C15H16N4O2S and a molecular weight of 316.39 g/mol. Its IUPAC name is N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
PubChem CID39344346
Molecular FormulaC15H16N4O2S
Molecular Weight316.39 g/mol
Exact Mass316.10
IUPAC NameN-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
SMILESCC(C)n1ncc2cc(NS(=O)(=O)c3ccccc3)cnc21
InChIInChI=1S/C15H16N4O2S/c1-11(2)19-15-12(9-17-19)8-13(10-16-15)18-22(20,21)14-6-4-3-5-7-14/h3-11,18H,1-2H3
InChIKeyXBRAHVYJVIYGJS-UHFFFAOYSA-N
XLogP2.81
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.39
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dichloro-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
CID 39344423
3-(benzenesulfonamido)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 26956441
3,4-dimethoxy-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
CID 39344439
3,4-diethoxy-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide
CID 39344535
(E)-2-phenyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)ethenesulfonamide
CID 39344411
3-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 55896598
ethane;N-quinolin-3-ylbenzenesulfonamide
CID 90950237
3-(ethylsulfamoyl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 38714189
2-[(3,4-dichlorophenyl)sulfonylamino]-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)propanamide
CID 42890223
3-(diethylsulfamoyl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 27693406
(2S)-2-(carbamoylamino)-3-phenyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)propanamide
CID 34313702
2-methyl-5-methylsulfonyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 26956314

Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide?
The IUPAC name of N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide (CID 39344346) is N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide.
What is the SMILES notation for N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide?
The canonical SMILES for N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide is CC(C)n1ncc2cc(NS(=O)(=O)c3ccccc3)cnc21.
What is the InChIKey of N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide?
The InChIKey is XBRAHVYJVIYGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2S/c1-11(2)19-15-12(9-17-19)8-13(10-16-15)18-22(20,21)14-6-4-3-5-7-14/h3-11,18H,1-2H3.
What are the key properties of N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide?
N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide has a molecular weight of 316.39 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzenesulfonamide is sourced from PubChem (CID 39344346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).