N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide

C17H20ClN3O3S — CID 9100739

IUPACN-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide
SMILESCc1ccc(NCC(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C17H20ClN3O3S/c1-12-4-7-15(10-16(12)25(23,24)21(2)3)19-11-17(22)20-14-8-5-13(18)6-9-14/h4-10,19H,11H2,1-3H3,(H,20,22)
InChIKeyOYPRYCJAZJGOKV-UHFFFAOYSA-N
MW381.89 g/mol
LogP2.95
Rot. Bonds6

About N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide

N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide (PubChem CID 9100739) has the molecular formula C17H20ClN3O3S and a molecular weight of 381.89 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide
PubChem CID9100739
Molecular FormulaC17H20ClN3O3S
Molecular Weight381.89 g/mol
Exact Mass381.09
IUPAC NameN-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide
SMILESCc1ccc(NCC(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C17H20ClN3O3S/c1-12-4-7-15(10-16(12)25(23,24)21(2)3)19-11-17(22)20-14-8-5-13(18)6-9-14/h4-10,19H,11H2,1-3H3,(H,20,22)
InChIKeyOYPRYCJAZJGOKV-UHFFFAOYSA-N
XLogP2.95
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.89
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide
CID 4847009
2-(2,4-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
CID 42965042
2-[3-(dimethylsulfamoyl)-4-methylanilino]-N-(3-fluorophenyl)acetamide
CID 9100777
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 26417269
(2S)-2-(4-chlorophenyl)-2-[[2-[3-(dimethylsulfamoyl)-4-methylanilino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 40843057
2-(4-chlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-hydroxyacetamide
CID 154862984
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-(2-fluoro-4-methylanilino)acetamide
CID 26438400
N-(3-chlorophenyl)-2-[[2-[3-(dimethylsulfamoyl)-4-methylanilino]-2-oxoethyl]-methylamino]acetamide
CID 55680503
2-[3-(dimethylsulfamoyl)-4-methylanilino]-N-(2-propan-2-ylphenyl)acetamide
CID 18096563
7-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]heptanamide
CID 119675156
N-(cyclopropylcarbamoyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide
CID 18096574
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-hydroxypentanamide
CID 79194533

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide (CID 9100739) is N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide is Cc1ccc(NCC(=O)Nc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C.
What is the InChIKey of N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide?
The InChIKey is OYPRYCJAZJGOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN3O3S/c1-12-4-7-15(10-16(12)25(23,24)21(2)3)19-11-17(22)20-14-8-5-13(18)6-9-14/h4-10,19H,11H2,1-3H3,(H,20,22).
What are the key properties of N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide?
N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide has a molecular weight of 381.89 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[3-(dimethylsulfamoyl)-4-methylanilino]acetamide is sourced from PubChem (CID 9100739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).