N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

C17H18N2O4S — CID 24542624

IUPACN-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCON(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1
InChIInChI=1S/C17H18N2O4S/c1-19(23-2)17(20)15-8-10-16(11-9-15)18-24(21,22)13-12-14-6-4-3-5-7-14/h3-13,18H,1-2H3/b13-12+
InChIKeyJYEXVADHYUZDSJ-OUKQBFOZSA-N
MW346.41 g/mol
LogP2.73
Rot. Bonds6

About N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (PubChem CID 24542624) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
PubChem CID24542624
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC NameN-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCON(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1
InChIInChI=1S/C17H18N2O4S/c1-19(23-2)17(20)15-8-10-16(11-9-15)18-24(21,22)13-12-14-6-4-3-5-7-14/h3-13,18H,1-2H3/b13-12+
InChIKeyJYEXVADHYUZDSJ-OUKQBFOZSA-N
XLogP2.73
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24546673
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
methyl 4-[[[4-[[(E)-2-phenylethenyl]sulfonylamino]benzoyl]amino]methyl]benzoate
CID 55348887
(E)-N-[4-(methanesulfonamido)phenyl]-2-phenylethenesulfonamide
CID 31073494
N,N-dimethyl-4-(2-phenylethenylsulfonylamino)benzenesulfonamide
CID 2997932
N-[3-(N-methylanilino)propyl]-4-[[(Z)-2-phenylethenyl]sulfonylamino]benzamide
CID 97428973
N-(2-methylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9341925
4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315088
N-(4-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9164162
N-[3-(dimethylsulfamoyl)phenyl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 6218294
ethyl 4-[[4-[[(E)-2-phenylethenyl]sulfonylamino]benzoyl]amino]benzoate
CID 24640952
N-(4-ethoxyphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24638590

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The IUPAC name of N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (CID 24542624) is N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.
What is the SMILES notation for N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The canonical SMILES for N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is CON(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1.
What is the InChIKey of N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The InChIKey is JYEXVADHYUZDSJ-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H18N2O4S/c1-19(23-2)17(20)15-8-10-16(11-9-15)18-24(21,22)13-12-14-6-4-3-5-7-14/h3-13,18H,1-2H3/b13-12+.
What are the key properties of N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide has a molecular weight of 346.41 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is sourced from PubChem (CID 24542624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).