N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide

C16H22N4O3S — CID 70724305

IUPACN-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide
SMILESCCCNC(=O)c1ccc(S(=O)(=O)NC(C)Cn2cccn2)cc1
InChIInChI=1S/C16H22N4O3S/c1-3-9-17-16(21)14-5-7-15(8-6-14)24(22,23)19-13(2)12-20-11-4-10-18-20/h4-8,10-11,13,19H,3,9,12H2,1-2H3,(H,17,21)
InChIKeyNDWYHMCWSFHQBV-UHFFFAOYSA-N
MW350.44 g/mol
LogP1.39
Rot. Bonds8

About N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide

N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide (PubChem CID 70724305) has the molecular formula C16H22N4O3S and a molecular weight of 350.44 g/mol. Its IUPAC name is N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide
PubChem CID70724305
Molecular FormulaC16H22N4O3S
Molecular Weight350.44 g/mol
Exact Mass350.14
IUPAC NameN-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide
SMILESCCCNC(=O)c1ccc(S(=O)(=O)NC(C)Cn2cccn2)cc1
InChIInChI=1S/C16H22N4O3S/c1-3-9-17-16(21)14-5-7-15(8-6-14)24(22,23)19-13(2)12-20-11-4-10-18-20/h4-8,10-11,13,19H,3,9,12H2,1-2H3,(H,17,21)
InChIKeyNDWYHMCWSFHQBV-UHFFFAOYSA-N
XLogP1.39
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-1-[4-(acetylsulfamoyl)phenyl]ethyl]-1-methyl-3-phenylpyrazole-5-carboxamide
CID 138756828
4-[(dimethylamino)sulfonyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide
CID 894979
1-benzyl-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-5-propylpyrazole-4-carboxamide
CID 118725463
N-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-(2-methylpropyl)-5-propylpyrazole-4-carboxamide
CID 118725464
3-(benzenesulfonamido)-N-[1-(4-methylphenyl)pyrazol-4-yl]benzamide
CID 148291912
N-[1-[4-(acetylsulfamoyl)phenyl]ethyl]-1-methyl-3-phenylpyrazole-5-carboxamide
CID 155554240
4-(dimethylsulfamoyl)-N-(1-methylpyrazol-3-yl)benzamide
CID 7638262
N-[1-(4-ethylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
CID 52935413
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 25163266
N-(2-cyclohexylpyrazol-3-yl)-4-(dimethylsulfamoyl)benzamide
CID 2095800
[4-(4-Methylphenyl)sulfonyl-1,4-diazepan-1-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone
CID 16333032
2-methyl-N-[(1S,5R,6S)-3-(4-methylphenyl)sulfonyl-3-azabicyclo[3.2.0]heptan-6-yl]pyrazole-3-carboxamide
CID 92558146

Frequently Asked Questions

What is the IUPAC name of N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide (CID 70724305) is N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide is CCCNC(=O)c1ccc(S(=O)(=O)NC(C)Cn2cccn2)cc1.
What is the InChIKey of N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide?
The InChIKey is NDWYHMCWSFHQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O3S/c1-3-9-17-16(21)14-5-7-15(8-6-14)24(22,23)19-13(2)12-20-11-4-10-18-20/h4-8,10-11,13,19H,3,9,12H2,1-2H3,(H,17,21).
What are the key properties of N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide?
N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide has a molecular weight of 350.44 g/mol, XLogP of 1.39, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-4-(1-pyrazol-1-ylpropan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 70724305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).