N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide

C19H24N2O3S — CID 2670988

IUPACN-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)(C)C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-14-9-11-16(12-10-14)21(5)25(23,24)17-8-6-7-15(13-17)18(22)20-19(2,3)4/h6-13H,1-5H3,(H,20,22)
InChIKeyJMWYXVRJIMRFOG-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.35
Rot. Bonds4

About N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide

N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide (PubChem CID 2670988) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
PubChem CID2670988
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)(C)C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-14-9-11-16(12-10-14)21(5)25(23,24)17-8-6-7-15(13-17)18(22)20-19(2,3)4/h6-13H,1-5H3,(H,20,22)
InChIKeyJMWYXVRJIMRFOG-UHFFFAOYSA-N
XLogP3.35
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-tert-butyl-3-[methyl(phenyl)sulfamoyl]benzamide
CID 4963740
N-(1-amino-2-methylpropan-2-yl)-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 119521508
methyl 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate
CID 9273487
N-methyl-N-(4-methylphenyl)-3-[(pyridine-4-carbonylamino)carbamoyl]benzenesulfonamide
CID 25163438
N-[2-(dimethylamino)-2-oxoethyl]-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 9480630
N-(3-hydroxyphenyl)-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 78783087
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 125043107
N-(3-methylbutyl)-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 2677261
3-[methyl-(4-methylphenyl)sulfamoyl]-N-(4-methylpiperazin-1-yl)benzamide
CID 9204956
N-[(1S)-1-(furan-2-yl)ethyl]-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 9481851
N-methyl-3-[methyl-(4-methylphenyl)sulfamoyl]-N-phenylbenzamide
CID 26536520
3-[methyl-(4-methylphenyl)sulfamoyl]-N-(4-methylpiperazin-4-ium-1-yl)benzamide
CID 9204955

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide (CID 2670988) is N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide is Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)(C)C)c2)cc1.
What is the InChIKey of N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide?
The InChIKey is JMWYXVRJIMRFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14-9-11-16(12-10-14)21(5)25(23,24)17-8-6-7-15(13-17)18(22)20-19(2,3)4/h6-13H,1-5H3,(H,20,22).
What are the key properties of N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide?
N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 2670988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).