2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide

C20H27N3O5S — CID 9084037

IUPAC2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C20H27N3O5S/c1-5-23(6-2)29(25,26)17-10-7-15(8-11-17)21-14-20(24)22-18-13-16(27-3)9-12-19(18)28-4/h7-13,21H,5-6,14H2,1-4H3,(H,22,24)
InChIKeyYIBBZMCOSKZFLD-UHFFFAOYSA-N
MW421.52 g/mol
LogP2.78
Rot. Bonds10

About 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide

2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide (PubChem CID 9084037) has the molecular formula C20H27N3O5S and a molecular weight of 421.52 g/mol. Its IUPAC name is 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide
PubChem CID9084037
Molecular FormulaC20H27N3O5S
Molecular Weight421.52 g/mol
Exact Mass421.17
IUPAC Name2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C20H27N3O5S/c1-5-23(6-2)29(25,26)17-10-7-15(8-11-17)21-14-20(24)22-18-13-16(27-3)9-12-19(18)28-4/h7-13,21H,5-6,14H2,1-4H3,(H,22,24)
InChIKeyYIBBZMCOSKZFLD-UHFFFAOYSA-N
XLogP2.78
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.52
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(diethylsulfamoyl)anilino]-N-(2,4-dimethoxyphenyl)acetamide
CID 9084136
2-[3-(diethylsulfamoyl)anilino]-N-(2,4-dimethoxyphenyl)acetamide
CID 29327817
N-[4-(diethylsulfamoyl)phenyl]-2-(2-methoxyanilino)acetamide
CID 9080497
2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 45372136
N-(2,5-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylsulfonylanilino)acetamide
CID 9083617
N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide
CID 54820345
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(2,5-dimethylanilino)acetamide
CID 26505603
N-(2,5-dimethoxyphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 51178370
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-[3-(2-phenylethynyl)anilino]acetamide
CID 25409083
4-[[2-(2,5-dimethoxyanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 54840532
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(naphthalen-1-ylamino)acetamide
CID 24510599
2-(2,5-dichloroanilino)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 24510593

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide (CID 9084037) is 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide is CCN(CC)S(=O)(=O)c1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1.
What is the InChIKey of 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is YIBBZMCOSKZFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O5S/c1-5-23(6-2)29(25,26)17-10-7-15(8-11-17)21-14-20(24)22-18-13-16(27-3)9-12-19(18)28-4/h7-13,21H,5-6,14H2,1-4H3,(H,22,24).
What are the key properties of 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide?
2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 421.52 g/mol, XLogP of 2.78, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 9084037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).