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

C20H22N2O3S — CID 11749023

IUPAC2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)18-8-6-7-9-19(18)21-26(24,25)17-12-10-16(3)11-13-17/h4-13,21H,1-2,14-15H2,3H3
InChIKeyAUKNHLIBVAZCNI-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.61
Rot. Bonds8

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

2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide (PubChem CID 11749023) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide.

Molecular Properties

Compound Name2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide
PubChem CID11749023
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)18-8-6-7-9-19(18)21-26(24,25)17-12-10-16(3)11-13-17/h4-13,21H,1-2,14-15H2,3H3
InChIKeyAUKNHLIBVAZCNI-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-methylphenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
CID 35742323
N-[(4-methylphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 2979882
2-[(4-chlorophenyl)sulfonylamino]-N,N-diethylbenzamide
CID 34838079
3-(4-methylphenyl)sulfonyl-1,1-bis(prop-2-enyl)urea
CID 4628428
N-benzyl-N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 58892098
N-[[2-[(4-methylphenyl)sulfonylamino]phenyl]methyl]prop-2-enamide
CID 57096689
4-methyl-N-[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzenesulfonamide
CID 4711775
N-(3-aminobutyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 119497804
N-(2-bromonaphthalen-1-yl)-N-methyl-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 135018198
2-[(4-methylphenyl)sulfonylamino]-N-(pyrrolidin-2-ylmethyl)benzamide
CID 75294143
1,3-bis[2-[(4-methylphenyl)sulfonylamino]phenyl]urea
CID 170548847
phenyl 2-[(4-methylphenyl)sulfonylamino]benzoate
CID 154135516

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide?
The IUPAC name of 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide (CID 11749023) is 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide.
What is the SMILES notation for 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide?
The canonical SMILES for 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide is C=CCN(CC=C)C(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide?
The InChIKey is AUKNHLIBVAZCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-4-14-22(15-5-2)20(23)18-8-6-7-9-19(18)21-26(24,25)17-12-10-16(3)11-13-17/h4-13,21H,1-2,14-15H2,3H3.
What are the key properties of 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide?
2-[(4-methylphenyl)sulfonylamino]-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 2-[(4-methylphenyl)sulfonylamino]-N,N-bis(prop-2-enyl)benzamide is sourced from PubChem (CID 11749023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).