N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide

C19H23Cl2N3O4S — CID 17425916

IUPACN-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide
SMILESCN(CCOc1ccc(S(=O)(=O)N(C)C)cc1)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C19H23Cl2N3O4S/c1-23(2)29(26,27)15-9-7-14(8-10-15)28-12-11-24(3)13-18(25)22-19-16(20)5-4-6-17(19)21/h4-10H,11-13H2,1-3H3,(H,22,25)
InChIKeyHFBAEIPDRQHKEB-UHFFFAOYSA-N
MW460.38 g/mol
LogP3.19
Rot. Bonds9

About N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide

N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide (PubChem CID 17425916) has the molecular formula C19H23Cl2N3O4S and a molecular weight of 460.38 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide
PubChem CID17425916
Molecular FormulaC19H23Cl2N3O4S
Molecular Weight460.38 g/mol
Exact Mass459.08
IUPAC NameN-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide
SMILESCN(CCOc1ccc(S(=O)(=O)N(C)C)cc1)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C19H23Cl2N3O4S/c1-23(2)29(26,27)15-9-7-14(8-10-15)28-12-11-24(3)13-18(25)22-19-16(20)5-4-6-17(19)21/h4-10H,11-13H2,1-3H3,(H,22,25)
InChIKeyHFBAEIPDRQHKEB-UHFFFAOYSA-N
XLogP3.19
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,6-dichlorophenyl)-2-[methyl-[2-(4-propoxyphenoxy)ethyl]amino]acetamide
CID 9287046
N-(2-chlorophenyl)-2-[methyl-[2-(4-sulfamoylphenoxy)ethyl]amino]acetamide
CID 38171543
N-(2,6-dichlorophenyl)-2-[ethyl-[2-(4-sulfamoylphenoxy)ethyl]amino]acetamide
CID 34926420
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(2,6-dichlorophenyl)acetamide
CID 126328873
[2-(2,6-dichloroanilino)-2-oxoethyl] 4-(dimethylsulfamoyl)benzoate
CID 2603676
N-[2-(dimethylamino)-5-(dimethylsulfamoyl)phenyl]-2-[methyl(2-phenoxyethyl)amino]acetamide
CID 39975511
2-[2-(4-chlorophenoxy)ethyl-methylamino]-N-(3-sulfamoylphenyl)acetamide
CID 9252524
N,N-dimethyl-4-[2-[methyl(2-phenoxyethyl)amino]ethoxy]benzenesulfonamide
CID 34689424
N-(2,6-dichlorophenyl)-2-[3-hydroxypropyl(methyl)amino]acetamide
CID 51225789
2-[2-(2-chlorophenoxy)ethyl-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 38302921
2-[2-(4-bromophenoxy)ethyl-methylamino]-N-(2,6-difluorophenyl)acetamide
CID 9288819
2-[2-(4-chlorophenoxy)ethyl-methylamino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 9252437

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide (CID 17425916) is N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide is CN(CCOc1ccc(S(=O)(=O)N(C)C)cc1)CC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide?
The InChIKey is HFBAEIPDRQHKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23Cl2N3O4S/c1-23(2)29(26,27)15-9-7-14(8-10-15)28-12-11-24(3)13-18(25)22-19-16(20)5-4-6-17(19)21/h4-10H,11-13H2,1-3H3,(H,22,25).
What are the key properties of N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide?
N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide has a molecular weight of 460.38 g/mol, XLogP of 3.19, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[2-[4-(dimethylsulfamoyl)phenoxy]ethyl-methylamino]acetamide is sourced from PubChem (CID 17425916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).