4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide

C20H22N2O3S — CID 78784352

IUPAC4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-15-22(16-5-2)20(23)17-11-13-19(14-12-17)26(24,25)21(3)18-9-7-6-8-10-18/h4-14H,1-2,15-16H2,3H3
InChIKeyXWVCABOMACKBRI-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.33
Rot. Bonds8

About 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide

4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide (PubChem CID 78784352) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide.

Molecular Properties

Compound Name4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
PubChem CID78784352
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-15-22(16-5-2)20(23)17-11-13-19(14-12-17)26(24,25)21(3)18-9-7-6-8-10-18/h4-14H,1-2,15-16H2,3H3
InChIKeyXWVCABOMACKBRI-UHFFFAOYSA-N
XLogP3.33
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 9098551
N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 21236527
N-butyl-N-(2-hydroxyethyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 78856047
[2-[bis(prop-2-enyl)amino]-2-oxoethyl] 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate
CID 16514948
N-butyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 8839615
N-(1-aminopropan-2-yl)-N-methyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 119583533
N,N-dibenzyl-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 126373552
2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
CID 55413423
4-[methyl(phenyl)sulfamoyl]-N-propylbenzamide
CID 2432115
N-[(4-methylphenyl)methyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 4801142
4-[benzenesulfonyl(methyl)amino]benzoic acid
CID 804306
4-acetyl-N,N-bis(prop-2-enyl)benzamide
CID 67089080

Frequently Asked Questions

What is the IUPAC name of 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The IUPAC name of 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide (CID 78784352) is 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide.
What is the SMILES notation for 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The canonical SMILES for 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide is C=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1.
What is the InChIKey of 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The InChIKey is XWVCABOMACKBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-4-15-22(16-5-2)20(23)17-11-13-19(14-12-17)26(24,25)21(3)18-9-7-6-8-10-18/h4-14H,1-2,15-16H2,3H3.
What are the key properties of 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide has a molecular weight of 370.47 g/mol, XLogP of 3.33, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide is sourced from PubChem (CID 78784352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).