N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide

C17H20N2O5S — CID 92643115

IUPACN-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC)cc2OC)cc1
InChIInChI=1S/C17H20N2O5S/c1-4-25(21,22)19-13-7-5-12(6-8-13)17(20)18-15-10-9-14(23-2)11-16(15)24-3/h5-11,19H,4H2,1-3H3,(H,18,20)
InChIKeyXGJWJPZBIYKAOM-UHFFFAOYSA-N
MW364.42 g/mol
LogP2.72
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide

N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide (PubChem CID 92643115) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide
PubChem CID92643115
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC NameN-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC)cc2OC)cc1
InChIInChI=1S/C17H20N2O5S/c1-4-25(21,22)19-13-7-5-12(6-8-13)17(20)18-15-10-9-14(23-2)11-16(15)24-3/h5-11,19H,4H2,1-3H3,(H,18,20)
InChIKeyXGJWJPZBIYKAOM-UHFFFAOYSA-N
XLogP2.72
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
4-(diethylamino)-N-(2,4-dimethoxyphenyl)benzamide
CID 9120164
1-N-(2,4-dimethoxyphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043198
4-N-butan-2-yl-1-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109044149
4-(benzenesulfonamido)-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126415575
4-chloro-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-3-iodobenzamide
CID 55956275
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109043393
4-N-(2,4-dimethoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045814
4-bromo-N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-3,5-dimethoxybenzamide
CID 55956522
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide (CID 92643115) is N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide is CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC)cc2OC)cc1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide?
The InChIKey is XGJWJPZBIYKAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-4-25(21,22)19-13-7-5-12(6-8-13)17(20)18-15-10-9-14(23-2)11-16(15)24-3/h5-11,19H,4H2,1-3H3,(H,18,20).
What are the key properties of N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide?
N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide has a molecular weight of 364.42 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-4-(ethylsulfonylamino)benzamide is sourced from PubChem (CID 92643115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).