N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide

C12H18N2O5S2 — CID 154139337

IUPACN-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NC(C)=O)cc1
InChIInChI=1S/C12H18N2O5S2/c1-4-14(5-2)21(18,19)12-8-6-11(7-9-12)20(16,17)13-10(3)15/h6-9H,4-5H2,1-3H3,(H,13,15)
InChIKeyTUWYWGVVLKXOIY-UHFFFAOYSA-N
MW334.42 g/mol
LogP0.54
Rot. Bonds6

About N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide

N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide (PubChem CID 154139337) has the molecular formula C12H18N2O5S2 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide
PubChem CID154139337
Molecular FormulaC12H18N2O5S2
Molecular Weight334.42 g/mol
Exact Mass334.07
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NC(C)=O)cc1
InChIInChI=1S/C12H18N2O5S2/c1-4-14(5-2)21(18,19)12-8-6-11(7-9-12)20(16,17)13-10(3)15/h6-9H,4-5H2,1-3H3,(H,13,15)
InChIKeyTUWYWGVVLKXOIY-UHFFFAOYSA-N
XLogP0.54
TPSA100.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-aminophenyl)sulfonylacetamide;N,N-diethylethanamine
CID 175178486
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
N-[4-[ethyl(2-hydroxyethyl)sulfamoyl]phenyl]acetamide
CID 39387601
N-[4-[butyl(ethyl)sulfamoyl]phenyl]acetamide
CID 2164655
N,N-diethyl-4-(ethylaminomethyl)benzenesulfonamide
CID 28715770
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N,N-diethyl-4-[[(4-methylbenzoyl)amino]carbamoyl]benzenesulfonamide
CID 2093173
N,N-diethyl-4-sulfanylbenzenesulfonamide
CID 15027344
[4-(diethylsulfamoyl)phenyl]azanium
CID 163754929
N-[5-(diethylsulfamoyl)-2-methylsulfanylphenyl]acetamide
CID 100500584
2-bromo-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 46736589
4-(dimethylamino)-N,N-diethylbenzenesulfonamide
CID 11043368

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide (CID 154139337) is N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide is CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NC(C)=O)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide?
The InChIKey is TUWYWGVVLKXOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O5S2/c1-4-14(5-2)21(18,19)12-8-6-11(7-9-12)20(16,17)13-10(3)15/h6-9H,4-5H2,1-3H3,(H,13,15).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide?
N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide has a molecular weight of 334.42 g/mol, XLogP of 0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide is sourced from PubChem (CID 154139337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).