N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide

C17H20N2O4S — CID 27241907

IUPACN-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide
SMILESCCCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(O)c2)c1
InChIInChI=1S/C17H20N2O4S/c1-3-10-19(2)24(22,23)16-9-4-6-13(11-16)17(21)18-14-7-5-8-15(20)12-14/h4-9,11-12,20H,3,10H2,1-2H3,(H,18,21)
InChIKeyZHECTRYTJBPIGD-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.67
Rot. Bonds6

About N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide

N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide (PubChem CID 27241907) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide
PubChem CID27241907
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide
SMILESCCCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(O)c2)c1
InChIInChI=1S/C17H20N2O4S/c1-3-10-19(2)24(22,23)16-9-4-6-13(11-16)17(21)18-14-7-5-8-15(20)12-14/h4-9,11-12,20H,3,10H2,1-2H3,(H,18,21)
InChIKeyZHECTRYTJBPIGD-UHFFFAOYSA-N
XLogP2.67
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(difluoromethyl)-4-fluorophenyl]-3-[methyl(propyl)sulfamoyl]benzamide
CID 129212231
N-(3-hydroxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 78783436
N-(3-hydroxyphenyl)-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 78783087
3-(dipropylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 26914144
3-(benzenesulfonyl)-N-(3-hydroxyphenyl)benzamide
CID 171989498
3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 109064666
3-[[3-(dibutylsulfamoyl)benzoyl]amino]benzoic acid
CID 4240708
N-(3-acetylphenyl)-4-[butyl(methyl)sulfamoyl]benzamide
CID 109061485
N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2221562
N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 7948731
3-[butyl(methyl)sulfamoyl]-N-(2,4-difluorophenyl)benzamide
CID 109065487
N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide?
The IUPAC name of N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide (CID 27241907) is N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide?
The canonical SMILES for N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide is CCCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(O)c2)c1.
What is the InChIKey of N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide?
The InChIKey is ZHECTRYTJBPIGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-10-19(2)24(22,23)16-9-4-6-13(11-16)17(21)18-14-7-5-8-15(20)12-14/h4-9,11-12,20H,3,10H2,1-2H3,(H,18,21).
What are the key properties of N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide?
N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide is sourced from PubChem (CID 27241907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).