[4-(diethylsulfamoyl)phenyl]azanium

C10H17N2O2S+ — CID 163754929

IUPAC[4-(diethylsulfamoyl)phenyl]azanium
SMILESCCN(CC)S(=O)(=O)c1ccc([NH3+])cc1
InChIInChI=1S/C10H16N2O2S/c1-3-12(4-2)15(13,14)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3/p+1
InChIKeyLTFVELCIFWEGGA-UHFFFAOYSA-O
MW229.33 g/mol
LogP0.59
Rot. Bonds4

About [4-(diethylsulfamoyl)phenyl]azanium

[4-(diethylsulfamoyl)phenyl]azanium (PubChem CID 163754929) has the molecular formula C10H17N2O2S+ and a molecular weight of 229.33 g/mol. Its IUPAC name is [4-(diethylsulfamoyl)phenyl]azanium.

Molecular Properties

Compound Name[4-(diethylsulfamoyl)phenyl]azanium
PubChem CID163754929
Molecular FormulaC10H17N2O2S+
Molecular Weight229.33 g/mol
Exact Mass229.10
IUPAC Name[4-(diethylsulfamoyl)phenyl]azanium
SMILESCCN(CC)S(=O)(=O)c1ccc([NH3+])cc1
InChIInChI=1S/C10H16N2O2S/c1-3-12(4-2)15(13,14)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3/p+1
InChIKeyLTFVELCIFWEGGA-UHFFFAOYSA-O
XLogP0.59
TPSA65.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [4-(diethylsulfamoyl)phenyl]azanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(diethylsulfamoyl)phenyl]methylazanium
CID 7129046
N,N-diethyl-4-sulfanylbenzenesulfonamide
CID 15027344
4-(dimethylamino)-N,N-diethylbenzenesulfonamide
CID 11043368
N,N-diethyl-4-trimethylsilylbenzenesulfonamide
CID 11254658
N,N-diethyl-4-(N-phenylanilino)benzenesulfonamide
CID 20654617
N,N-diethyl-4-(ethylaminomethyl)benzenesulfonamide
CID 28715770
4-(2-deuterioethynyl)-N,N-diethylbenzenesulfonamide
CID 163281778
N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide
CID 154139337
N-ethyl-4-methyl-N-propylbenzenesulfonamide
CID 91734520
N-benzyl-N-ethylbenzenesulfonamide
CID 668950
4-(2-amino-1,1,1,3,3,3-hexafluoropropan-2-yl)-N,N-diethylbenzenesulfonamide
CID 24996616
4-[(1R)-2-bromo-1-hydroxyethyl]-N,N-diethylbenzenesulfonamide
CID 25324249

Frequently Asked Questions

What is the IUPAC name of [4-(diethylsulfamoyl)phenyl]azanium?
The IUPAC name of [4-(diethylsulfamoyl)phenyl]azanium (CID 163754929) is [4-(diethylsulfamoyl)phenyl]azanium.
What is the SMILES notation for [4-(diethylsulfamoyl)phenyl]azanium?
The canonical SMILES for [4-(diethylsulfamoyl)phenyl]azanium is CCN(CC)S(=O)(=O)c1ccc([NH3+])cc1.
What is the InChIKey of [4-(diethylsulfamoyl)phenyl]azanium?
The InChIKey is LTFVELCIFWEGGA-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H16N2O2S/c1-3-12(4-2)15(13,14)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3/p+1.
What are the key properties of [4-(diethylsulfamoyl)phenyl]azanium?
[4-(diethylsulfamoyl)phenyl]azanium has a molecular weight of 229.33 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(diethylsulfamoyl)phenyl]azanium is sourced from PubChem (CID 163754929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).