N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide

C17H20N2O4S — CID 78800316

IUPACN-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)NCC(C)O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-12-3-7-15(8-4-12)19-24(22,23)16-9-5-14(6-10-16)17(21)18-11-13(2)20/h3-10,13,19-20H,11H2,1-2H3,(H,18,21)
InChIKeyTZEIPVMOJNIJJA-UHFFFAOYSA-N
MW348.42 g/mol
LogP1.91
Rot. Bonds6

About N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide

N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide (PubChem CID 78800316) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
PubChem CID78800316
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)NCC(C)O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-12-3-7-15(8-4-12)19-24(22,23)16-9-5-14(6-10-16)17(21)18-11-13(2)20/h3-10,13,19-20H,11H2,1-2H3,(H,18,21)
InChIKeyTZEIPVMOJNIJJA-UHFFFAOYSA-N
XLogP1.91
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
4-[[4-(dimethylamino)phenyl]sulfamoyl]-N-(2-methylpropyl)benzamide
CID 109058890
N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-4-propan-2-ylbenzamide
CID 3628664
4-[(4-fluorophenyl)sulfamoyl]-N-[(4-methylphenyl)methyl]benzamide
CID 26850932
N-[(2R)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 25391278
N-methoxy-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 27745145
4-(benzenesulfonamido)-N-[2-(dimethylamino)-3-methylbutyl]benzamide
CID 24650129
4-[(4-methylphenyl)sulfamoyl]-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]benzamide
CID 56558023
N-(2-hydroxypropyl)-4-(prop-2-ynylsulfamoyl)benzamide
CID 78856021
4-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-hydroxypropyl)benzamide
CID 78803253
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 55735491

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide (CID 78800316) is N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide is Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NCC(C)O)cc2)cc1.
What is the InChIKey of N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide?
The InChIKey is TZEIPVMOJNIJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-12-3-7-15(8-4-12)19-24(22,23)16-9-5-14(6-10-16)17(21)18-11-13(2)20/h3-10,13,19-20H,11H2,1-2H3,(H,18,21).
What are the key properties of N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide?
N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide has a molecular weight of 348.42 g/mol, XLogP of 1.91, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 78800316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).