N-(4-aminophenyl)-N-ethylethanesulfonamide

C10H16N2O2S — CID 63233742

IUPACN-(4-aminophenyl)-N-ethylethanesulfonamide
SMILESCCN(c1ccc(N)cc1)S(=O)(=O)CC
InChIInChI=1S/C10H16N2O2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3
InChIKeyURXGCATVBQLARM-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.44
Rot. Bonds4

About N-(4-aminophenyl)-N-ethylethanesulfonamide

N-(4-aminophenyl)-N-ethylethanesulfonamide (PubChem CID 63233742) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-ethylethanesulfonamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-ethylethanesulfonamide
PubChem CID63233742
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-(4-aminophenyl)-N-ethylethanesulfonamide
SMILESCCN(c1ccc(N)cc1)S(=O)(=O)CC
InChIInChI=1S/C10H16N2O2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3
InChIKeyURXGCATVBQLARM-UHFFFAOYSA-N
XLogP1.44
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-aminophenyl)-N-ethylpropane-2-sulfonamide
CID 63233825
4-N-(diethylsulfamoyl)-4-N-propylbenzene-1,4-diamine
CID 63233725
N-[2-(4-amino-N-ethylsulfonylanilino)ethyl]-N-methylacetamide
CID 18005661
N-(4-aminophenyl)-N-propylbutane-1-sulfonamide
CID 55173436
N-(4-aminophenyl)-N-propylpropane-2-sulfonamide
CID 63233852
N-(4-aminophenyl)-4-bromo-N-ethylbenzenesulfonamide
CID 63233827
N-(4-aminophenyl)-N-methylpropane-1-sulfonamide
CID 28894568
N-(5-amino-2-pyridinyl)-N-ethylethanesulfonamide
CID 115268162
N-(4-aminophenyl)-1-phenyl-N-propylmethanesulfonamide
CID 63233636
N-(4-aminophenyl)-N-ethyl-2,5-dimethylbenzenesulfonamide
CID 63234087
N-(4-aminophenyl)-N,5-diethylthiophene-2-sulfonamide
CID 63234172
N-(4-aminophenyl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide
CID 63233869

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-ethylethanesulfonamide?
The IUPAC name of N-(4-aminophenyl)-N-ethylethanesulfonamide (CID 63233742) is N-(4-aminophenyl)-N-ethylethanesulfonamide.
What is the SMILES notation for N-(4-aminophenyl)-N-ethylethanesulfonamide?
The canonical SMILES for N-(4-aminophenyl)-N-ethylethanesulfonamide is CCN(c1ccc(N)cc1)S(=O)(=O)CC.
What is the InChIKey of N-(4-aminophenyl)-N-ethylethanesulfonamide?
The InChIKey is URXGCATVBQLARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-3-12(15(13,14)4-2)10-7-5-9(11)6-8-10/h5-8H,3-4,11H2,1-2H3.
What are the key properties of N-(4-aminophenyl)-N-ethylethanesulfonamide?
N-(4-aminophenyl)-N-ethylethanesulfonamide has a molecular weight of 228.32 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-ethylethanesulfonamide is sourced from PubChem (CID 63233742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).