2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide

C16H17ClN2O5S — CID 992285

IUPAC2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1
InChIInChI=1S/C16H17ClN2O5S/c1-10-7-13(17)15(8-14(10)24-9-16(18)20)25(21,22)19-11-3-5-12(23-2)6-4-11/h3-8,19H,9H2,1-2H3,(H2,18,20)
InChIKeyWGASFKOVFXTKIW-UHFFFAOYSA-N
MW384.84 g/mol
LogP2.32
Rot. Bonds7

About 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide

2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide (PubChem CID 992285) has the molecular formula C16H17ClN2O5S and a molecular weight of 384.84 g/mol. Its IUPAC name is 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
PubChem CID992285
Molecular FormulaC16H17ClN2O5S
Molecular Weight384.84 g/mol
Exact Mass384.05
IUPAC Name2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1
InChIInChI=1S/C16H17ClN2O5S/c1-10-7-13(17)15(8-14(10)24-9-16(18)20)25(21,22)19-11-3-5-12(23-2)6-4-11/h3-8,19H,9H2,1-2H3,(H2,18,20)
InChIKeyWGASFKOVFXTKIW-UHFFFAOYSA-N
XLogP2.32
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.84
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The IUPAC name of 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide (CID 992285) is 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide is COc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1.
What is the InChIKey of 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The InChIKey is WGASFKOVFXTKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O5S/c1-10-7-13(17)15(8-14(10)24-9-16(18)20)25(21,22)19-11-3-5-12(23-2)6-4-11/h3-8,19H,9H2,1-2H3,(H2,18,20).
What are the key properties of 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide has a molecular weight of 384.84 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-5-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide is sourced from PubChem (CID 992285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).