(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide

C17H19NO5S — CID 71745323

IUPAC(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cccc2OC)cc1
InChIInChI=1S/C17H19NO5S/c1-21-14-9-7-13(8-10-14)18-24(19,20)12-11-15-16(22-2)5-4-6-17(15)23-3/h4-12,18H,1-3H3/b12-11+
InChIKeyAHOPPSNRLZUMIK-VAWYXSNFSA-N
MW349.41 g/mol
LogP3.12
Rot. Bonds7

About (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide

(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide (PubChem CID 71745323) has the molecular formula C17H19NO5S and a molecular weight of 349.41 g/mol. Its IUPAC name is (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
PubChem CID71745323
Molecular FormulaC17H19NO5S
Molecular Weight349.41 g/mol
Exact Mass349.10
IUPAC Name(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)/C=C/c2c(OC)cccc2OC)cc1
InChIInChI=1S/C17H19NO5S/c1-21-14-9-7-13(8-10-14)18-24(19,20)12-11-15-16(22-2)5-4-6-17(15)23-3/h4-12,18H,1-3H3/b12-11+
InChIKeyAHOPPSNRLZUMIK-VAWYXSNFSA-N
XLogP3.12
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(E)-2-(4-hydroxy-2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
CID 71745325
(E)-N-(4-methoxyphenyl)-2-phenylethenesulfonamide
CID 767425
(E)-2-(2,4-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
CID 71745322
(E)-N-(4-methoxyphenyl)prop-1-ene-1-sulfonamide
CID 70401574
1,3-dimethoxy-2-[(E)-2-[(4-methoxyphenyl)methylsulfonyl]ethenyl]benzene
CID 10132484
(Z)-1-cyano-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide
CID 68941943
N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)ethenesulfonamide
CID 70038153
N-(2-amino-4-methoxyphenyl)-2-(2,4,6-trimethoxyphenyl)ethenesulfonamide
CID 67317738
(E)-2-(3,4-dimethoxyphenyl)-N-phenylethenesulfonamide
CID 1487582
(E)-N-(3-fluoro-4-methoxyphenyl)-2-(2,3,4,5,6-pentafluorophenyl)ethenesulfonamide
CID 71746427
[2-methoxy-5-[[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonylamino]phenyl] 2,2,2-trifluoroacetate
CID 67102628
2-[2-methoxy-5-[2-(2,4,6-trimethoxyphenyl)ethenylsulfonylamino]anilino]acetic acid
CID 66810663

Frequently Asked Questions

What is the IUPAC name of (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The IUPAC name of (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide (CID 71745323) is (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide.
What is the SMILES notation for (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The canonical SMILES for (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide is COc1ccc(NS(=O)(=O)/C=C/c2c(OC)cccc2OC)cc1.
What is the InChIKey of (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
The InChIKey is AHOPPSNRLZUMIK-VAWYXSNFSA-N. The full InChI is InChI=1S/C17H19NO5S/c1-21-14-9-7-13(8-10-14)18-24(19,20)12-11-15-16(22-2)5-4-6-17(15)23-3/h4-12,18H,1-3H3/b12-11+.
What are the key properties of (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide?
(E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide has a molecular weight of 349.41 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(2,6-dimethoxyphenyl)-N-(4-methoxyphenyl)ethenesulfonamide is sourced from PubChem (CID 71745323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).