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

C17H19ClN2O5S — CID 992267

IUPAC2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCCOc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1
InChIInChI=1S/C17H19ClN2O5S/c1-3-24-13-6-4-12(5-7-13)20-26(22,23)16-9-15(25-10-17(19)21)11(2)8-14(16)18/h4-9,20H,3,10H2,1-2H3,(H2,19,21)
InChIKeyVJZXDAYLNUETLV-UHFFFAOYSA-N
MW398.87 g/mol
LogP2.71
Rot. Bonds8

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

2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide (PubChem CID 992267) has the molecular formula C17H19ClN2O5S and a molecular weight of 398.87 g/mol. Its IUPAC name is 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
PubChem CID992267
Molecular FormulaC17H19ClN2O5S
Molecular Weight398.87 g/mol
Exact Mass398.07
IUPAC Name2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCCOc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1
InChIInChI=1S/C17H19ClN2O5S/c1-3-24-13-6-4-12(5-7-13)20-26(22,23)16-9-15(25-10-17(19)21)11(2)8-14(16)18/h4-9,20H,3,10H2,1-2H3,(H2,19,21)
InChIKeyVJZXDAYLNUETLV-UHFFFAOYSA-N
XLogP2.71
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.87
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Fenasulam
CID 12923188
N-[4-({[2-(4-chloro-2-methylphenoxy)ethyl]amino}sulfonyl)phenyl]acetamide
CID 607667
2-(4-Chloro-5-{[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl}-2-methylphenoxy)acetamide
CID 992270
2-[4-Chloro-2-methyl-5-(3-toluidinosulfonyl)phenoxy]acetamide
CID 992283
2-[4-Chloro-2-methyl-5-(4-toluidinosulfonyl)phenoxy]acetamide
CID 992284
2-{4-Chloro-5-[(4-methoxyanilino)sulfonyl]-2-methylphenoxy}acetamide
CID 992285
2-{4-Chloro-5-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)sulfonyl]-2-methylphenoxy}acetamide
CID 992286
2-(5-{[(3-Acetylphenyl)amino]sulfonyl}-4-chloro-2-methylphenoxy)acetamide
CID 1288702
2-{5-[(1,3-Benzodioxol-5-ylamino)sulfonyl]-4-chloro-2-methylphenoxy}acetamide
CID 1290492
2-{5-[(Benzylamino)sulfonyl]-4-chloro-2-methylphenoxy}acetamide
CID 2201088
2-[4-chloro-2-methyl-5-[methyl(phenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide
CID 2204489
2-[4-Chloro-5-({[2-fluoro-5-(4-morpholinylsulfonyl)phenyl]amino}sulfonyl)-2-methylphenoxy]acetamide
CID 2950774

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The IUPAC name of 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide (CID 992267) is 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide is CCOc1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1.
What is the InChIKey of 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The InChIKey is VJZXDAYLNUETLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O5S/c1-3-24-13-6-4-12(5-7-13)20-26(22,23)16-9-15(25-10-17(19)21)11(2)8-14(16)18/h4-9,20H,3,10H2,1-2H3,(H2,19,21).
What are the key properties of 2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide?
2-[4-chloro-5-[(4-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide has a molecular weight of 398.87 g/mol, XLogP of 2.71, 8 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-ethoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide is sourced from PubChem (CID 992267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).