2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide

C18H23N3O3S — CID 1289236

IUPAC2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C18H23N3O3S/c1-4-15-10-12-16(13-11-15)19-18(22)14-21(25(23,24)20(2)3)17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3,(H,19,22)
InChIKeyFWUXGHDSUCMRBM-UHFFFAOYSA-N
MW361.47 g/mol
LogP2.50
Rot. Bonds7

About 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide

2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide (PubChem CID 1289236) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide
PubChem CID1289236
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC Name2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C18H23N3O3S/c1-4-15-10-12-16(13-11-15)19-18(22)14-21(25(23,24)20(2)3)17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3,(H,19,22)
InChIKeyFWUXGHDSUCMRBM-UHFFFAOYSA-N
XLogP2.50
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide (CID 1289236) is 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide?
The InChIKey is FWUXGHDSUCMRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-4-15-10-12-16(13-11-15)19-18(22)14-21(25(23,24)20(2)3)17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3,(H,19,22).
What are the key properties of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide?
2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide has a molecular weight of 361.47 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 1289236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).