N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide

C19H24N2O4S — CID 18197987

IUPACN-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
SMILESCCc1cccc(CC)c1NC(=O)c1cccc(S(=O)(=O)N(C)OC)c1
InChIInChI=1S/C19H24N2O4S/c1-5-14-9-7-10-15(6-2)18(14)20-19(22)16-11-8-12-17(13-16)26(23,24)21(3)25-4/h7-13H,5-6H2,1-4H3,(H,20,22)
InChIKeyCKKQOTXMOGXYRX-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.25
Rot. Bonds7

About N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide

N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide (PubChem CID 18197987) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
PubChem CID18197987
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
SMILESCCc1cccc(CC)c1NC(=O)c1cccc(S(=O)(=O)N(C)OC)c1
InChIInChI=1S/C19H24N2O4S/c1-5-14-9-7-10-15(6-2)18(14)20-19(22)16-11-8-12-17(13-16)26(23,24)21(3)25-4/h7-13H,5-6H2,1-4H3,(H,20,22)
InChIKeyCKKQOTXMOGXYRX-UHFFFAOYSA-N
XLogP3.25
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1,3-benzodioxol-5-yl)-3-[methoxy(methyl)sulfamoyl]benzamide
CID 9191609
3-[methoxy(methyl)sulfamoyl]-N-(2,3,4-trifluorophenyl)benzamide
CID 18197948
N-(4,5-dimethoxy-2-methylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
CID 18198075
3-[methoxy(methyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
CID 51250979
N-(5-fluoro-2-methylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
CID 9208555
N-(2-chloro-4-fluorophenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
CID 51204944
3-[methoxy(methyl)sulfamoyl]-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 9207030
3-[methoxy(methyl)sulfamoyl]-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 55672469
N-methoxy-N-methyl-3-[[(3-nitrobenzoyl)amino]carbamoyl]benzenesulfonamide
CID 35125317
3-[methoxy(methyl)sulfamoyl]-N-(6-methylheptan-2-yl)benzamide
CID 51204934
3-[methoxy(methyl)sulfamoyl]-N-(2-methyl-3-nitrophenyl)benzamide
CID 9270787
2-[[3-[methoxy(methyl)sulfamoyl]benzoyl]amino]-N-(2-methylpropyl)benzamide
CID 34731063

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide?
The IUPAC name of N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide (CID 18197987) is N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide is CCc1cccc(CC)c1NC(=O)c1cccc(S(=O)(=O)N(C)OC)c1.
What is the InChIKey of N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide?
The InChIKey is CKKQOTXMOGXYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-14-9-7-10-15(6-2)18(14)20-19(22)16-11-8-12-17(13-16)26(23,24)21(3)25-4/h7-13H,5-6H2,1-4H3,(H,20,22).
What are the key properties of N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide?
N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide has a molecular weight of 376.48 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-3-[methoxy(methyl)sulfamoyl]benzamide is sourced from PubChem (CID 18197987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).