N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide

C18H20Cl2N2O4S — CID 126210637

IUPACN-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
SMILESCC(C)CNS(=O)(=O)c1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C18H20Cl2N2O4S/c1-12(2)10-21-27(24,25)15-6-4-14(5-7-15)26-11-18(23)22-13-3-8-16(19)17(20)9-13/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)
InChIKeyHBAODHQGWSTGDK-UHFFFAOYSA-N
MW431.34 g/mol
LogP3.95
Rot. Bonds8

About N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide

N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide (PubChem CID 126210637) has the molecular formula C18H20Cl2N2O4S and a molecular weight of 431.34 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
PubChem CID126210637
Molecular FormulaC18H20Cl2N2O4S
Molecular Weight431.34 g/mol
Exact Mass430.05
IUPAC NameN-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
SMILESCC(C)CNS(=O)(=O)c1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C18H20Cl2N2O4S/c1-12(2)10-21-27(24,25)15-6-4-14(5-7-15)26-11-18(23)22-13-3-8-16(19)17(20)9-13/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)
InChIKeyHBAODHQGWSTGDK-UHFFFAOYSA-N
XLogP3.95
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.34
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
CID 126212360
2-[4-(butylsulfamoyl)phenoxy]-N-(3,4-dichlorophenyl)acetamide
CID 4046445
N-(3,5-dimethylphenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
CID 126204216
2-(4-acetamidophenoxy)-N-(3,4-dichlorophenyl)acetamide
CID 1296256
N-(3-chloro-4-methoxyphenyl)-2-[2-methyl-4-(2-methylpropylsulfamoyl)phenoxy]acetamide
CID 1243560
N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
CID 706860
2-[4-(2-methylpropylsulfamoyl)phenoxy]-N-(pyridin-4-ylmethyl)acetamide
CID 11837026
N-[(2R)-butan-2-yl]-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide
CID 126213893
2-(4-chloro-3-methylphenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 4924502
2-[4-(2-methylpropylsulfamoyl)phenoxy]-N-(2,3,4-trifluorophenyl)acetamide
CID 28552672
2-[2-chloro-4-(2-methylpropylsulfamoyl)phenoxy]-N-(3-chlorophenyl)acetamide
CID 126263338
N-(4-chlorophenyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
CID 5185109

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide (CID 126210637) is N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide is CC(C)CNS(=O)(=O)c1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide?
The InChIKey is HBAODHQGWSTGDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O4S/c1-12(2)10-21-27(24,25)15-6-4-14(5-7-15)26-11-18(23)22-13-3-8-16(19)17(20)9-13/h3-9,12,21H,10-11H2,1-2H3,(H,22,23).
What are the key properties of N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide?
N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide has a molecular weight of 431.34 g/mol, XLogP of 3.95, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-[4-(2-methylpropylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 126210637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).