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

C24H24N2O4S — CID 24546673

IUPACN-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCOc1ccccc1CN(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1
InChIInChI=1S/C24H24N2O4S/c1-26(18-21-10-6-7-11-23(21)30-2)24(27)20-12-14-22(15-13-20)25-31(28,29)17-16-19-8-4-3-5-9-19/h3-17,25H,18H2,1-2H3/b17-16+
InChIKeyUIVFBGRYAIHYJH-WUKNDPDISA-N
MW436.53 g/mol
LogP4.38
Rot. Bonds8

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

N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (PubChem CID 24546673) has the molecular formula C24H24N2O4S and a molecular weight of 436.53 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
PubChem CID24546673
Molecular FormulaC24H24N2O4S
Molecular Weight436.53 g/mol
Exact Mass436.15
IUPAC NameN-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
SMILESCOc1ccccc1CN(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1
InChIInChI=1S/C24H24N2O4S/c1-26(18-21-10-6-7-11-23(21)30-2)24(27)20-12-14-22(15-13-20)25-31(28,29)17-16-19-8-4-3-5-9-19/h3-17,25H,18H2,1-2H3/b17-16+
InChIKeyUIVFBGRYAIHYJH-WUKNDPDISA-N
XLogP4.38
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.53
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methoxy-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 24542624
N-[(2-methoxyphenyl)methyl]-N-methyl-2-phenylethenesulfonamide
CID 4885028
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
N-[(2-methoxyphenyl)methyl]-N-methyl-4-[(N-methylsulfonylanilino)methyl]benzamide
CID 28578521
3-chloro-4-iodo-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 103221354
methyl 4-[[[4-[[(E)-2-phenylethenyl]sulfonylamino]benzoyl]amino]methyl]benzoate
CID 55348887
4-(cyclopropylcarbamoylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 55665974
4-bromo-3,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 17412285
4-methoxy-N-[(2-methoxyphenyl)methyl]-N-methyl-3-(propan-2-ylsulfamoyl)benzamide
CID 24546681
(E)-N-[4-(methanesulfonamido)phenyl]-2-phenylethenesulfonamide
CID 31073494
N-(4-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9164162
N-[(2,3-dimethoxyphenyl)methyl]-4-[(2,5-dimethylphenyl)sulfonylamino]-N-methylbenzamide
CID 27786521

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide (CID 24546673) is N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is COc1ccccc1CN(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
The InChIKey is UIVFBGRYAIHYJH-WUKNDPDISA-N. The full InChI is InChI=1S/C24H24N2O4S/c1-26(18-21-10-6-7-11-23(21)30-2)24(27)20-12-14-22(15-13-20)25-31(28,29)17-16-19-8-4-3-5-9-19/h3-17,25H,18H2,1-2H3/b17-16+.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide?
N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide has a molecular weight of 436.53 g/mol, XLogP of 4.38, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N-methyl-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is sourced from PubChem (CID 24546673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).