N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide

C18H22N2O3S — CID 109065077

IUPACN,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCCN(CC)C(=O)c1cccc(S(=O)(=O)Nc2ccccc2C)c1
InChIInChI=1S/C18H22N2O3S/c1-4-20(5-2)18(21)15-10-8-11-16(13-15)24(22,23)19-17-12-7-6-9-14(17)3/h6-13,19H,4-5H2,1-3H3
InChIKeyIUDDZXBORVHDMZ-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.28
Rot. Bonds6

About N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide

N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide (PubChem CID 109065077) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
PubChem CID109065077
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC NameN,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCCN(CC)C(=O)c1cccc(S(=O)(=O)Nc2ccccc2C)c1
InChIInChI=1S/C18H22N2O3S/c1-4-20(5-2)18(21)15-10-8-11-16(13-15)24(22,23)19-17-12-7-6-9-14(17)3/h6-13,19H,4-5H2,1-3H3
InChIKeyIUDDZXBORVHDMZ-UHFFFAOYSA-N
XLogP3.28
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 78796489
N,N-diethyl-4-[[4-[(2-methylphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 34542806
3-[[4-(dimethylamino)phenyl]sulfamoyl]-N,N-diethylbenzamide
CID 109065116
3-[(4-acetylphenyl)sulfamoyl]-N,N-diethylbenzamide
CID 109065110
3-[[2-chloro-5-(trifluoromethyl)phenyl]sulfamoyl]-N,N-diethylbenzamide
CID 26583597
3-[[4-(diethylamino)-2-methylphenyl]sulfamoyl]benzoic acid
CID 25043576
N-(2-methylphenyl)-3-[3-[(2-methylphenyl)sulfamoyl]phenyl]sulfonylbenzenesulfonamide
CID 2833501
N,N-diethyl-3-(prop-2-enylsulfamoyl)benzamide
CID 51161787
N,N-diethyl-3-(pentylsulfamoyl)benzamide
CID 109065070
3-[(2-chlorophenyl)sulfamoyl]-N-[2-oxo-2-(propylamino)ethyl]-N-propylbenzamide
CID 55863638
N-benzyl-N-ethyl-3-(methylsulfamoyl)benzamide
CID 100623214
3-[(5-fluoro-2-methylphenyl)sulfamoyl]-N,N-dimethylbenzamide
CID 87026306

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The IUPAC name of N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide (CID 109065077) is N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide is CCN(CC)C(=O)c1cccc(S(=O)(=O)Nc2ccccc2C)c1.
What is the InChIKey of N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The InChIKey is IUDDZXBORVHDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-4-20(5-2)18(21)15-10-8-11-16(13-15)24(22,23)19-17-12-7-6-9-14(17)3/h6-13,19H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide has a molecular weight of 346.45 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 109065077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).