N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide

C19H24N2O3S — CID 109063056

IUPACN-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCCC(C)NC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)c(C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-5-15(4)20-19(22)16-7-6-8-18(12-16)25(23,24)21-17-10-9-13(2)14(3)11-17/h6-12,15,21H,5H2,1-4H3,(H,20,22)
InChIKeyWWKGLPGKTFUZCZ-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.63
Rot. Bonds6

About N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide

N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide (PubChem CID 109063056) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
PubChem CID109063056
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCCC(C)NC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)c(C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-5-15(4)20-19(22)16-7-6-8-18(12-16)25(23,24)21-17-10-9-13(2)14(3)11-17/h6-12,15,21H,5H2,1-4H3,(H,20,22)
InChIKeyWWKGLPGKTFUZCZ-UHFFFAOYSA-N
XLogP3.63
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-3-[(2,4,6-trimethylphenyl)sulfamoyl]benzamide
CID 109063065
N-butan-2-yl-3-[(4-cyanophenyl)sulfamoyl]benzamide
CID 109063102
N-butan-2-yl-3-[(2,3-dimethylphenyl)sulfamoyl]benzamide
CID 109063059
N-[(2S)-butan-2-yl]-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 41448539
N-(3,4-dimethylphenyl)-3-propanoylbenzenesulfonamide
CID 112838625
3-[(4-methylphenyl)sulfamoyl]-N-pentan-2-ylbenzamide
CID 132654290
N-(1-hydroxypropan-2-yl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 78856434
3-[(4-methylphenyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 26499000
N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-(methylsulfamoyl)benzamide
CID 31307957
3-[(3,4-dimethylphenyl)sulfamoyl]-N-(pyridin-4-ylmethyl)benzamide
CID 109064949
3-[(3,5-dimethylphenyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 109062181
N-butan-2-yl-2-[[3-[(2,5-dimethylphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 90681061

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide (CID 109063056) is N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide is CCC(C)NC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)c(C)c2)c1.
What is the InChIKey of N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The InChIKey is WWKGLPGKTFUZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-5-15(4)20-19(22)16-7-6-8-18(12-16)25(23,24)21-17-10-9-13(2)14(3)11-17/h6-12,15,21H,5H2,1-4H3,(H,20,22).
What are the key properties of N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 109063056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).