N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide

C20H24N2O3S — CID 29265946

IUPACN-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C20H24N2O3S/c1-5-22(14-15(2)3)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(4)7-11-18/h6-13,21H,2,5,14H2,1,3-4H3
InChIKeyURVOEQQPPYPSMP-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.83
Rot. Bonds7

About N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide

N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide (PubChem CID 29265946) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide
PubChem CID29265946
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C20H24N2O3S/c1-5-22(14-15(2)3)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(4)7-11-18/h6-13,21H,2,5,14H2,1,3-4H3
InChIKeyURVOEQQPPYPSMP-UHFFFAOYSA-N
XLogP3.83
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(3-chloro-4-fluorophenyl)sulfonylamino]-N-ethyl-N-(2-methylprop-2-enyl)benzamide
CID 31832383
4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
CID 35742323
N,N-dibenzyl-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 1252923
4-acetamido-N-ethyl-N-(2-methylprop-2-enyl)benzamide
CID 37012021
N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 46653296
4-[(4-methylphenyl)sulfamoyl]-N,N-bis(2-phenylethyl)benzamide
CID 2343621
4-chloro-N,N-diethyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 169370448
N-ethyl-N-(2-hydroxyethyl)-4-(phenylsulfamoyl)benzamide
CID 78796066
N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 34338889
N-ethyl-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(2-methylprop-2-enyl)benzamide
CID 134008813
3-[(4-acetylphenyl)sulfamoyl]-N,N-diethylbenzamide
CID 109065110
4-[(3,4-dimethylphenyl)sulfamoyl]-N-ethyl-N-(2-hydroxyethyl)benzamide
CID 78796492

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide?
The IUPAC name of N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide (CID 29265946) is N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide.
What is the SMILES notation for N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide?
The canonical SMILES for N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide is C=C(C)CN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide?
The InChIKey is URVOEQQPPYPSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-5-22(14-15(2)3)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(4)7-11-18/h6-13,21H,2,5,14H2,1,3-4H3.
What are the key properties of N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide?
N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide has a molecular weight of 372.49 g/mol, XLogP of 3.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide is sourced from PubChem (CID 29265946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).