N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C23H25N5O4S — CID 16620962

IUPACN-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)c1
InChIInChI=1S/C23H25N5O4S/c1-5-28(6-2)33(30,31)17-10-7-9-16(13-17)24-23(29)18-14-19(20-11-8-12-32-20)25-22-21(18)15(3)26-27(22)4/h7-14H,5-6H2,1-4H3,(H,24,29)
InChIKeyPGYQBXADGCGGOW-UHFFFAOYSA-N
MW467.55 g/mol
LogP3.82
Rot. Bonds7

About N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 16620962) has the molecular formula C23H25N5O4S and a molecular weight of 467.55 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID16620962
Molecular FormulaC23H25N5O4S
Molecular Weight467.55 g/mol
Exact Mass467.16
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)c1
InChIInChI=1S/C23H25N5O4S/c1-5-28(6-2)33(30,31)17-10-7-9-16(13-17)24-23(29)18-14-19(20-11-8-12-32-20)25-22-21(18)15(3)26-27(22)4/h7-14H,5-6H2,1-4H3,(H,24,29)
InChIKeyPGYQBXADGCGGOW-UHFFFAOYSA-N
XLogP3.82
TPSA110.33 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.55
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(furan-2-yl)-1,3-dimethyl-N-(4-methylsulfonylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 24627205
6-(furan-2-yl)-1,3-dimethyl-N-(4-methylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 16609317
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16621304
N-(3,4-diethoxyphenyl)-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16621919
6-(furan-2-yl)-1,3-dimethyl-N-naphthalen-1-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16620803
6-(furan-2-yl)-1,3-dimethyl-N-[4-(methylcarbamoyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 16622390
N-[2,6-di(propan-2-yl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16620877
S-[4-[[6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56576852
6-(furan-2-yl)-1,3-dimethyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55962171
N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16622496
N-[4-(dimethylamino)-2-methylphenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55780235
diethyl 2-[[6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]propanedioate
CID 55513345

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 16620962) is N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cc(-c3ccco3)nc3c2c(C)nn3C)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is PGYQBXADGCGGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O4S/c1-5-28(6-2)33(30,31)17-10-7-9-16(13-17)24-23(29)18-14-19(20-11-8-12-32-20)25-22-21(18)15(3)26-27(22)4/h7-14H,5-6H2,1-4H3,(H,24,29).
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 467.55 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)phenyl]-6-(furan-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 16620962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).