3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide

C17H24N4O3S — CID 30183038

IUPAC3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccnn2C(C)C)c1
InChIInChI=1S/C17H24N4O3S/c1-5-20(6-2)25(23,24)15-9-7-8-14(12-15)17(22)19-16-10-11-18-21(16)13(3)4/h7-13H,5-6H2,1-4H3,(H,19,22)
InChIKeyQRHAACLTMDLARU-UHFFFAOYSA-N
MW364.47 g/mol
LogP2.75
Rot. Bonds7

About 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide

3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide (PubChem CID 30183038) has the molecular formula C17H24N4O3S and a molecular weight of 364.47 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
PubChem CID30183038
Molecular FormulaC17H24N4O3S
Molecular Weight364.47 g/mol
Exact Mass364.16
IUPAC Name3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccnn2C(C)C)c1
InChIInChI=1S/C17H24N4O3S/c1-5-20(6-2)25(23,24)15-9-7-8-14(12-15)17(22)19-16-10-11-18-21(16)13(3)4/h7-13H,5-6H2,1-4H3,(H,19,22)
InChIKeyQRHAACLTMDLARU-UHFFFAOYSA-N
XLogP2.75
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methoxyethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 55631775
3-(benzylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 30186121
3-(diethylsulfamoyl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 27693406
3-(diethylsulfamoyl)-N-methylbenzamide
CID 47099917
N-(2-butan-2-ylpyrazol-3-yl)-5-(diethylsulfamoyl)-2-methylbenzamide
CID 78778551
3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide
CID 793744
N-[2-[(2R)-butan-2-yl]phenyl]-3-(diethylsulfamoyl)benzamide
CID 2670766
3-(diethylsulfamoyl)-N-(3-methylpentan-2-yl)benzamide
CID 60579922
N-[(2S)-1-aminopropan-2-yl]-3-(diethylsulfamoyl)benzamide
CID 120505672
N,N-diethyl-3-[(3-methylbutanoylamino)carbamoyl]benzenesulfonamide
CID 26654579
3-(diethylsulfamoyl)-N-(4-ethylphenyl)benzamide
CID 2684396
N-(2-propan-2-ylpyrazol-3-yl)naphthalene-2-carboxamide
CID 30183164

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide?
The IUPAC name of 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide (CID 30183038) is 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide is CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccnn2C(C)C)c1.
What is the InChIKey of 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide?
The InChIKey is QRHAACLTMDLARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3S/c1-5-20(6-2)25(23,24)15-9-7-8-14(12-15)17(22)19-16-10-11-18-21(16)13(3)4/h7-13H,5-6H2,1-4H3,(H,19,22).
What are the key properties of 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide?
3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide has a molecular weight of 364.47 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide is sourced from PubChem (CID 30183038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).