2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide

C16H17ClN2O4S — CID 992283

IUPAC2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
SMILESCc1cccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)c1
InChIInChI=1S/C16H17ClN2O4S/c1-10-4-3-5-12(6-10)19-24(21,22)15-8-14(23-9-16(18)20)11(2)7-13(15)17/h3-8,19H,9H2,1-2H3,(H2,18,20)
InChIKeyWMSATIJAXKQDGR-UHFFFAOYSA-N
MW368.84 g/mol
LogP2.62
Rot. Bonds6

About 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide

2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide (PubChem CID 992283) has the molecular formula C16H17ClN2O4S and a molecular weight of 368.84 g/mol. Its IUPAC name is 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
PubChem CID992283
Molecular FormulaC16H17ClN2O4S
Molecular Weight368.84 g/mol
Exact Mass368.06
IUPAC Name2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
SMILESCc1cccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)c1
InChIInChI=1S/C16H17ClN2O4S/c1-10-4-3-5-12(6-10)19-24(21,22)15-8-14(23-9-16(18)20)11(2)7-13(15)17/h3-8,19H,9H2,1-2H3,(H2,18,20)
InChIKeyWMSATIJAXKQDGR-UHFFFAOYSA-N
XLogP2.62
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.84
LogP ≤ 52.62
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-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The IUPAC name of 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide (CID 992283) is 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide is Cc1cccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)c1.
What is the InChIKey of 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The InChIKey is WMSATIJAXKQDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O4S/c1-10-4-3-5-12(6-10)19-24(21,22)15-8-14(23-9-16(18)20)11(2)7-13(15)17/h3-8,19H,9H2,1-2H3,(H2,18,20).
What are the key properties of 2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
2-[4-chloro-2-methyl-5-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide has a molecular weight of 368.84 g/mol, XLogP of 2.62, 6 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-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide is sourced from PubChem (CID 992283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).