2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

C16H17ClN2O3S — CID 1346695

IUPAC2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H17ClN2O3S/c17-14-5-1-13(2-6-14)11-16(20)19-10-9-12-3-7-15(8-4-12)23(18,21)22/h1-8H,9-11H2,(H,19,20)(H2,18,21,22)
InChIKeyGWTJPQWQEBUCJR-UHFFFAOYSA-N
MW352.84 g/mol
LogP1.89
Rot. Bonds6

About 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (PubChem CID 1346695) has the molecular formula C16H17ClN2O3S and a molecular weight of 352.84 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
PubChem CID1346695
Molecular FormulaC16H17ClN2O3S
Molecular Weight352.84 g/mol
Exact Mass352.06
IUPAC Name2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H17ClN2O3S/c17-14-5-1-13(2-6-14)11-16(20)19-10-9-12-3-7-15(8-4-12)23(18,21)22/h1-8H,9-11H2,(H,19,20)(H2,18,21,22)
InChIKeyGWTJPQWQEBUCJR-UHFFFAOYSA-N
XLogP1.89
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (CID 1346695) is 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is NS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is GWTJPQWQEBUCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3S/c17-14-5-1-13(2-6-14)11-16(20)19-10-9-12-3-7-15(8-4-12)23(18,21)22/h1-8H,9-11H2,(H,19,20)(H2,18,21,22).
What are the key properties of 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 352.84 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 1346695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).