5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide

C19H24N2O6S — CID 133203803

IUPAC5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide
SMILESCNC(=O)c1cc(S(=O)(=O)NC(C)c2cc(OC)ccc2OC)ccc1OC
InChIInChI=1S/C19H24N2O6S/c1-12(15-10-13(25-3)6-8-17(15)26-4)21-28(23,24)14-7-9-18(27-5)16(11-14)19(22)20-2/h6-12,21H,1-5H3,(H,20,22)
InChIKeyGJSKXJGVWFPRIU-UHFFFAOYSA-N
MW408.48 g/mol
LogP2.11
Rot. Bonds8

About 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide

5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide (PubChem CID 133203803) has the molecular formula C19H24N2O6S and a molecular weight of 408.48 g/mol. Its IUPAC name is 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide
PubChem CID133203803
Molecular FormulaC19H24N2O6S
Molecular Weight408.48 g/mol
Exact Mass408.14
IUPAC Name5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide
SMILESCNC(=O)c1cc(S(=O)(=O)NC(C)c2cc(OC)ccc2OC)ccc1OC
InChIInChI=1S/C19H24N2O6S/c1-12(15-10-13(25-3)6-8-17(15)26-4)21-28(23,24)14-7-9-18(27-5)16(11-14)19(22)20-2/h6-12,21H,1-5H3,(H,20,22)
InChIKeyGJSKXJGVWFPRIU-UHFFFAOYSA-N
XLogP2.11
TPSA102.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide?
The IUPAC name of 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide (CID 133203803) is 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide.
What is the SMILES notation for 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide?
The canonical SMILES for 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide is CNC(=O)c1cc(S(=O)(=O)NC(C)c2cc(OC)ccc2OC)ccc1OC.
What is the InChIKey of 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide?
The InChIKey is GJSKXJGVWFPRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O6S/c1-12(15-10-13(25-3)6-8-17(15)26-4)21-28(23,24)14-7-9-18(27-5)16(11-14)19(22)20-2/h6-12,21H,1-5H3,(H,20,22).
What are the key properties of 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide?
5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide has a molecular weight of 408.48 g/mol, XLogP of 2.11, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2,5-dimethoxyphenyl)ethylsulfamoyl]-2-methoxy-N-methylbenzamide is sourced from PubChem (CID 133203803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).