N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide

C18H23N3O3S — CID 4879510

IUPACN-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide
SMILESCc1cc(C)cc(NC(=O)CNc2cccc(S(=O)(=O)N(C)C)c2)c1
InChIInChI=1S/C18H23N3O3S/c1-13-8-14(2)10-16(9-13)20-18(22)12-19-15-6-5-7-17(11-15)25(23,24)21(3)4/h5-11,19H,12H2,1-4H3,(H,20,22)
InChIKeyCQQOVKDOFTUTSN-UHFFFAOYSA-N
MW361.47 g/mol
LogP2.60
Rot. Bonds6

About N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide

N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide (PubChem CID 4879510) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide
PubChem CID4879510
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC NameN-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide
SMILESCc1cc(C)cc(NC(=O)CNc2cccc(S(=O)(=O)N(C)C)c2)c1
InChIInChI=1S/C18H23N3O3S/c1-13-8-14(2)10-16(9-13)20-18(22)12-19-15-6-5-7-17(11-15)25(23,24)21(3)4/h5-11,19H,12H2,1-4H3,(H,20,22)
InChIKeyCQQOVKDOFTUTSN-UHFFFAOYSA-N
XLogP2.60
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylsulfamoyl)phenyl]-2-(3-methylanilino)acetamide
CID 51178270
N-(3,4-difluorophenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide
CID 9084347
2-(3,4-dichloroanilino)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 9098781
2-[3-(dimethylsulfamoyl)anilino]-N-naphthalen-1-ylacetamide
CID 9084353
N-[3-(dimethylsulfamoyl)phenyl]-2-(3-piperidin-1-ylsulfonylanilino)acetamide
CID 16553103
2-(2,5-dichloroanilino)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 26416969
2-(4-bromo-2-fluoroanilino)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 42125792
2-(butan-2-ylamino)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 60646929
[2-[3-(dimethylsulfamoyl)anilino]-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 8729171
2-(3-cyanoanilino)-N-(3,5-dimethylphenyl)acetamide
CID 26438593
N-[3-(dimethylsulfamoyl)phenyl]-3-(3-methylphenyl)propanamide
CID 51277442
2-(cyclopropylmethylamino)-N-[3-(dimethylsulfamoyl)phenyl]acetamide;hydrochloride
CID 119672943

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide (CID 4879510) is N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide is Cc1cc(C)cc(NC(=O)CNc2cccc(S(=O)(=O)N(C)C)c2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide?
The InChIKey is CQQOVKDOFTUTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-13-8-14(2)10-16(9-13)20-18(22)12-19-15-6-5-7-17(11-15)25(23,24)21(3)4/h5-11,19H,12H2,1-4H3,(H,20,22).
What are the key properties of N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide?
N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide has a molecular weight of 361.47 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-[3-(dimethylsulfamoyl)anilino]acetamide is sourced from PubChem (CID 4879510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).