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

C17H20N2O4S — CID 2496330

IUPAC2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESCOc1ccc(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-23-15-6-2-14(3-7-15)12-17(20)19-11-10-13-4-8-16(9-5-13)24(18,21)22/h2-9H,10-12H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyYHZHYXGYKHITQD-UHFFFAOYSA-N
MW348.42 g/mol
LogP1.24
Rot. Bonds7

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

2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (PubChem CID 2496330) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
PubChem CID2496330
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESCOc1ccc(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-23-15-6-2-14(3-7-15)12-17(20)19-11-10-13-4-8-16(9-5-13)24(18,21)22/h2-9H,10-12H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyYHZHYXGYKHITQD-UHFFFAOYSA-N
XLogP1.24
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (CID 2496330) is 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is COc1ccc(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is YHZHYXGYKHITQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-23-15-6-2-14(3-7-15)12-17(20)19-11-10-13-4-8-16(9-5-13)24(18,21)22/h2-9H,10-12H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 348.42 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 2496330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).