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

C20H22N2O3S — CID 35742323

IUPAC4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(3)7-11-18/h4-13,21H,1-2,14-15H2,3H3
InChIKeyBAEKYFGZBGLYAS-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.61
Rot. Bonds8

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

4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide (PubChem CID 35742323) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide.

Molecular Properties

Compound Name4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
PubChem CID35742323
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(3)7-11-18/h4-13,21H,1-2,14-15H2,3H3
InChIKeyBAEKYFGZBGLYAS-UHFFFAOYSA-N
XLogP3.61
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.61
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-[(4-ethoxyphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
CID 35742507
N-ethyl-4-[(4-methylphenyl)sulfamoyl]-N-(2-methylprop-2-enyl)benzamide
CID 29265946
N,N-dibenzyl-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 1252923
4-[(4-methylphenyl)sulfamoyl]-N,N-bis(2-phenylethyl)benzamide
CID 2343621
2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide
CID 11749023
3-(4-methylphenyl)sulfonyl-1,1-bis(prop-2-enyl)urea
CID 4628428
N-(4-methylphenyl)-4-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 4994558
4-[(4-methylphenyl)sulfonylamino]benzamide
CID 837332
N-[[4-[(4-methylphenyl)sulfamoyl]phenyl]methyl]prop-2-enamide
CID 57217486
ethyl 4-[4-[(4-methylphenyl)sulfonylamino]phenyl]benzoate
CID 169371543
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
3-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)propanamide
CID 17154050

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide (CID 35742323) is 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide.
What is the SMILES notation for 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The canonical SMILES for 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide is C=CCN(CC=C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
The InChIKey is BAEKYFGZBGLYAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)17-8-12-19(13-9-17)26(24,25)21-18-10-6-16(3)7-11-18/h4-13,21H,1-2,14-15H2,3H3.
What are the key properties of 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide?
4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide has a molecular weight of 370.47 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide is sourced from PubChem (CID 35742323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).