(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide

C10H14N2O2S — CID 43603519

IUPAC(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide
SMILESNCCNS(=O)(=O)/C=C/c1ccccc1
InChIInChI=1S/C10H14N2O2S/c11-7-8-12-15(13,14)9-6-10-4-2-1-3-5-10/h1-6,9,12H,7-8,11H2/b9-6+
InChIKeyGPAJPYFEEFHKAC-RMKNXTFCSA-N
MW226.30 g/mol
LogP0.54
Rot. Bonds5

About (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide

(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide (PubChem CID 43603519) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide.

Molecular Properties

Compound Name(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide
PubChem CID43603519
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC Name(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide
SMILESNCCNS(=O)(=O)/C=C/c1ccccc1
InChIInChI=1S/C10H14N2O2S/c11-7-8-12-15(13,14)9-6-10-4-2-1-3-5-10/h1-6,9,12H,7-8,11H2/b9-6+
InChIKeyGPAJPYFEEFHKAC-RMKNXTFCSA-N
XLogP0.54
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide 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

N-(2-aminoethyl)-2-(3-bromophenyl)ethenesulfonamide
CID 127265568
(E)-N-[2-(ethylamino)ethyl]-2-phenylethenesulfonamide
CID 55100588
(E)-N-ethyl-2-phenylethenesulfonamide
CID 43212835
(E)-N-(2-amino-2-phenylethyl)-2-phenylethenesulfonamide
CID 43605703
2-(2-phenylethenylsulfonylamino)acetate
CID 4137274
(E)-N-[2-(3-hydroxypropylsulfanyl)ethyl]-2-phenylethenesulfonamide
CID 103834908
N-(3-aminopropyl)-2-(4-bromophenyl)ethenesulfonamide;hydrochloride
CID 127265571
(E)-N-[3-(2-methoxyethoxy)propyl]-2-phenylethenesulfonamide
CID 47121888
(E)-2-phenyl-N-(3-piperidin-1-ium-1-ylpropyl)ethenesulfonamide
CID 8823993
(E)-N-(3-aminopropyl)-2-(3-bromophenyl)ethenesulfonamide;hydrochloride
CID 84591296
(E)-N-methyl-2-phenylethenesulfonamide
CID 2427246
(E)-2-phenyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]ethenesulfonamide
CID 34105825

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide?
The IUPAC name of (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide (CID 43603519) is (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide.
What is the SMILES notation for (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide?
The canonical SMILES for (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide is NCCNS(=O)(=O)/C=C/c1ccccc1.
What is the InChIKey of (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide?
The InChIKey is GPAJPYFEEFHKAC-RMKNXTFCSA-N. The full InChI is InChI=1S/C10H14N2O2S/c11-7-8-12-15(13,14)9-6-10-4-2-1-3-5-10/h1-6,9,12H,7-8,11H2/b9-6+.
What are the key properties of (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide?
(E)-N-(2-aminoethyl)-2-phenylethenesulfonamide has a molecular weight of 226.30 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-aminoethyl)-2-phenylethenesulfonamide is sourced from PubChem (CID 43603519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).