2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide

C10H13ClN2O4S — CID 851368

IUPAC2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide
SMILESCNS(=O)(=O)c1cc(OCC(N)=O)c(C)cc1Cl
InChIInChI=1S/C10H13ClN2O4S/c1-6-3-7(11)9(18(15,16)13-2)4-8(6)17-5-10(12)14/h3-4,13H,5H2,1-2H3,(H2,12,14)
InChIKeyYDEDTXVIZVBCFY-UHFFFAOYSA-N
MW292.74 g/mol
LogP0.42
Rot. Bonds5

About 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide

2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide (PubChem CID 851368) has the molecular formula C10H13ClN2O4S and a molecular weight of 292.74 g/mol. Its IUPAC name is 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide
PubChem CID851368
Molecular FormulaC10H13ClN2O4S
Molecular Weight292.74 g/mol
Exact Mass292.03
IUPAC Name2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide
SMILESCNS(=O)(=O)c1cc(OCC(N)=O)c(C)cc1Cl
InChIInChI=1S/C10H13ClN2O4S/c1-6-3-7(11)9(18(15,16)13-2)4-8(6)17-5-10(12)14/h3-4,13H,5H2,1-2H3,(H2,12,14)
InChIKeyYDEDTXVIZVBCFY-UHFFFAOYSA-N
XLogP0.42
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.74
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide?
The IUPAC name of 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide (CID 851368) is 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide is CNS(=O)(=O)c1cc(OCC(N)=O)c(C)cc1Cl.
What is the InChIKey of 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide?
The InChIKey is YDEDTXVIZVBCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O4S/c1-6-3-7(11)9(18(15,16)13-2)4-8(6)17-5-10(12)14/h3-4,13H,5H2,1-2H3,(H2,12,14).
What are the key properties of 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide?
2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide has a molecular weight of 292.74 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-2-methyl-5-(methylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 851368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).