N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide

C22H19N5O3S — CID 55528695

IUPACN-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2ccc(-n3cccn3)nc2)c1
InChIInChI=1S/C22H19N5O3S/c1-26(19-8-3-2-4-9-19)31(29,30)20-10-5-7-18(15-20)25-22(28)17-11-12-21(23-16-17)27-14-6-13-24-27/h2-16H,1H3,(H,25,28)
InChIKeyIRMGHLAFUVBCSV-UHFFFAOYSA-N
MW433.49 g/mol
LogP3.34
Rot. Bonds6

About N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide

N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide (PubChem CID 55528695) has the molecular formula C22H19N5O3S and a molecular weight of 433.49 g/mol. Its IUPAC name is N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide
PubChem CID55528695
Molecular FormulaC22H19N5O3S
Molecular Weight433.49 g/mol
Exact Mass433.12
IUPAC NameN-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2ccc(-n3cccn3)nc2)c1
InChIInChI=1S/C22H19N5O3S/c1-26(19-8-3-2-4-9-19)31(29,30)20-10-5-7-18(15-20)25-22(28)17-11-12-21(23-16-17)27-14-6-13-24-27/h2-16H,1H3,(H,25,28)
InChIKeyIRMGHLAFUVBCSV-UHFFFAOYSA-N
XLogP3.34
TPSA97.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.49
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-[methyl(phenyl)sulfamoyl]phenyl]-1-phenylpyrazole-4-carboxamide
CID 25436790
N-(3-fluorophenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 16654238
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2H-benzotriazole-5-carboxamide
CID 25325336
1-(3-chlorophenyl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]pyrazole-4-carboxamide
CID 60529641
N-[3-(diethylsulfamoyl)phenyl]-4-pyrazol-1-ylbenzamide
CID 25442987
N-(3-hydroxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 78783436
3-(2,2-dimethylpropanoylamino)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 35186261
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-6-pyrazol-1-ylpyridine-3-carboxamide
CID 25470960
N-[3-(dimethylsulfamoyl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 31865595
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 4290143
N-methyl-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3758867
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide
CID 55332136

Frequently Asked Questions

What is the IUPAC name of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide (CID 55528695) is N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide is CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2ccc(-n3cccn3)nc2)c1.
What is the InChIKey of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The InChIKey is IRMGHLAFUVBCSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O3S/c1-26(19-8-3-2-4-9-19)31(29,30)20-10-5-7-18(15-20)25-22(28)17-11-12-21(23-16-17)27-14-6-13-24-27/h2-16H,1H3,(H,25,28).
What are the key properties of N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide has a molecular weight of 433.49 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[methyl(phenyl)sulfamoyl]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 55528695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).