N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide

C19H24N2O3S2 — CID 9415957

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CSc2ccccc2C)cc1
InChIInChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)17-12-10-16(11-13-17)20-19(22)14-25-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyGEYPRQQEQACXCK-UHFFFAOYSA-N
MW392.55 g/mol
LogP3.76
Rot. Bonds8

About N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide

N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide (PubChem CID 9415957) has the molecular formula C19H24N2O3S2 and a molecular weight of 392.55 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide
PubChem CID9415957
Molecular FormulaC19H24N2O3S2
Molecular Weight392.55 g/mol
Exact Mass392.12
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CSc2ccccc2C)cc1
InChIInChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)17-12-10-16(11-13-17)20-19(22)14-25-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyGEYPRQQEQACXCK-UHFFFAOYSA-N
XLogP3.76
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methylphenyl)sulfanyl-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 38351202
N-(4-fluorophenyl)-2-(2-methylphenyl)sulfanylacetamide
CID 5051825
2-(2-chlorophenyl)sulfanyl-N-[3-(diethylsulfamoyl)phenyl]acetamide
CID 7950472
ethyl 4-[[2-(2-methylphenyl)sulfanylacetyl]amino]benzoate
CID 5011495
N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide
CID 2458881
2-(2,4-dimethylphenyl)sulfanyl-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2616332
N-[4-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-ylsulfanylacetamide
CID 9457949
N-[4-(diethylsulfamoyl)phenyl]-4-phenylsulfanylbutanamide
CID 18075261
2-bromo-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 46736589
N-(3-iodo-4-methylphenyl)-2-(2-methylphenyl)sulfanylacetamide
CID 7925479
N-[4-(diethylsulfamoyl)phenyl]-2-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 23905429
[2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl] N,N-dimethylcarbamodithioate
CID 3251537

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide (CID 9415957) is N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CSc2ccccc2C)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide?
The InChIKey is GEYPRQQEQACXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)17-12-10-16(11-13-17)20-19(22)14-25-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,20,22).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide has a molecular weight of 392.55 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide is sourced from PubChem (CID 9415957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).