N-[(E)-2-aminoethenyl]benzenesulfonamide

C8H10N2O2S — CID 66690063

IUPACN-[(E)-2-aminoethenyl]benzenesulfonamide
SMILESN/C=C/NS(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10N2O2S/c9-6-7-10-13(11,12)8-4-2-1-3-5-8/h1-7,10H,9H2/b7-6+
InChIKeyVSNMFFHDFKQRPZ-VOTSOKGWSA-N
MW198.25 g/mol
LogP0.39
Rot. Bonds3

About N-[(E)-2-aminoethenyl]benzenesulfonamide

N-[(E)-2-aminoethenyl]benzenesulfonamide (PubChem CID 66690063) has the molecular formula C8H10N2O2S and a molecular weight of 198.25 g/mol. Its IUPAC name is N-[(E)-2-aminoethenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[(E)-2-aminoethenyl]benzenesulfonamide
PubChem CID66690063
Molecular FormulaC8H10N2O2S
Molecular Weight198.25 g/mol
Exact Mass198.05
IUPAC NameN-[(E)-2-aminoethenyl]benzenesulfonamide
SMILESN/C=C/NS(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10N2O2S/c9-6-7-10-13(11,12)8-4-2-1-3-5-8/h1-7,10H,9H2/b7-6+
InChIKeyVSNMFFHDFKQRPZ-VOTSOKGWSA-N
XLogP0.39
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-aminoethenyl]benzenesulfonamide?
The IUPAC name of N-[(E)-2-aminoethenyl]benzenesulfonamide (CID 66690063) is N-[(E)-2-aminoethenyl]benzenesulfonamide.
What is the SMILES notation for N-[(E)-2-aminoethenyl]benzenesulfonamide?
The canonical SMILES for N-[(E)-2-aminoethenyl]benzenesulfonamide is N/C=C/NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-[(E)-2-aminoethenyl]benzenesulfonamide?
The InChIKey is VSNMFFHDFKQRPZ-VOTSOKGWSA-N. The full InChI is InChI=1S/C8H10N2O2S/c9-6-7-10-13(11,12)8-4-2-1-3-5-8/h1-7,10H,9H2/b7-6+.
What are the key properties of N-[(E)-2-aminoethenyl]benzenesulfonamide?
N-[(E)-2-aminoethenyl]benzenesulfonamide has a molecular weight of 198.25 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-aminoethenyl]benzenesulfonamide is sourced from PubChem (CID 66690063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).