N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide

C19H24N2O3S — CID 7948731

IUPACN-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide
SMILESCCCCN(C)S(=O)(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-4-5-13-21(3)25(23,24)18-11-9-17(10-12-18)20-19(22)16-8-6-7-15(2)14-16/h6-12,14H,4-5,13H2,1-3H3,(H,20,22)
InChIKeyOUDLDBYGAXQWCR-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.67
Rot. Bonds7

About N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide

N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide (PubChem CID 7948731) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide
PubChem CID7948731
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide
SMILESCCCCN(C)S(=O)(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-4-5-13-21(3)25(23,24)18-11-9-17(10-12-18)20-19(22)16-8-6-7-15(2)14-16/h6-12,14H,4-5,13H2,1-3H3,(H,20,22)
InChIKeyOUDLDBYGAXQWCR-UHFFFAOYSA-N
XLogP3.67
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-(difluoromethoxy)benzamide
CID 7948721
N-(3-acetylphenyl)-4-[butyl(methyl)sulfamoyl]benzamide
CID 109061485
N-[4-[butyl(methyl)sulfamoyl]phenyl]-3,4-dimethoxybenzamide
CID 9218315
N-[4-[butyl(methyl)sulfamoyl]phenyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 9011474
3-bromo-N-[4-(dibutylsulfamoyl)phenyl]benzamide
CID 4121831
N-[4-[butyl(methyl)sulfamoyl]phenyl]-4-methylsulfanylbenzamide
CID 8623651
N-[4-[butyl(methyl)sulfamoyl]phenyl]-5,6-dichloropyridine-3-carboxamide
CID 7733390
N-[4-[butyl(methyl)sulfamoyl]phenyl]-4-methoxy-3-nitrobenzamide
CID 7948730
3-methyl-N-[4-(pentylamino)phenyl]benzamide
CID 112985190
N-[4-[butyl(methyl)sulfamoyl]phenyl]-1H-indole-2-carboxamide
CID 9223899
N-[4-[butyl(methyl)sulfamoyl]phenyl]-2-(3,5-dimethylphenoxy)acetamide
CID 8750734
N-[4-(diethylamino)phenyl]-3-methylbenzamide
CID 835431

Frequently Asked Questions

What is the IUPAC name of N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide?
The IUPAC name of N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide (CID 7948731) is N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide.
What is the SMILES notation for N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide?
The canonical SMILES for N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide is CCCCN(C)S(=O)(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1.
What is the InChIKey of N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide?
The InChIKey is OUDLDBYGAXQWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-4-5-13-21(3)25(23,24)18-11-9-17(10-12-18)20-19(22)16-8-6-7-15(2)14-16/h6-12,14H,4-5,13H2,1-3H3,(H,20,22).
What are the key properties of N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide?
N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide has a molecular weight of 360.48 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-methylbenzamide is sourced from PubChem (CID 7948731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).