4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide

C15H18N2O4S2 — CID 7423322

IUPAC4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide
SMILESCOc1ccc(C(=O)NCCS(=O)(=O)NCc2cccs2)cc1
InChIInChI=1S/C15H18N2O4S2/c1-21-13-6-4-12(5-7-13)15(18)16-8-10-23(19,20)17-11-14-3-2-9-22-14/h2-7,9,17H,8,10-11H2,1H3,(H,16,18)
InChIKeyHIEKJBKXWSIFGO-UHFFFAOYSA-N
MW354.45 g/mol
LogP1.61
Rot. Bonds8

About 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide

4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide (PubChem CID 7423322) has the molecular formula C15H18N2O4S2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide
PubChem CID7423322
Molecular FormulaC15H18N2O4S2
Molecular Weight354.45 g/mol
Exact Mass354.07
IUPAC Name4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide
SMILESCOc1ccc(C(=O)NCCS(=O)(=O)NCc2cccs2)cc1
InChIInChI=1S/C15H18N2O4S2/c1-21-13-6-4-12(5-7-13)15(18)16-8-10-23(19,20)17-11-14-3-2-9-22-14/h2-7,9,17H,8,10-11H2,1H3,(H,16,18)
InChIKeyHIEKJBKXWSIFGO-UHFFFAOYSA-N
XLogP1.61
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide (CID 7423322) is 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide is COc1ccc(C(=O)NCCS(=O)(=O)NCc2cccs2)cc1.
What is the InChIKey of 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide?
The InChIKey is HIEKJBKXWSIFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S2/c1-21-13-6-4-12(5-7-13)15(18)16-8-10-23(19,20)17-11-14-3-2-9-22-14/h2-7,9,17H,8,10-11H2,1H3,(H,16,18).
What are the key properties of 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide?
4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide has a molecular weight of 354.45 g/mol, XLogP of 1.61, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-(thiophen-2-ylmethylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 7423322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).