1-(benzenesulfonyl)-N-ethenylethenamine

C10H11NO2S — CID 67900326

IUPAC1-(benzenesulfonyl)-N-ethenylethenamine
SMILESC=CNC(=C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C10H11NO2S/c1-3-11-9(2)14(12,13)10-7-5-4-6-8-10/h3-8,11H,1-2H2
InChIKeyMKTAHYZDYPEPOD-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.66
Rot. Bonds4

About 1-(benzenesulfonyl)-N-ethenylethenamine

1-(benzenesulfonyl)-N-ethenylethenamine (PubChem CID 67900326) has the molecular formula C10H11NO2S and a molecular weight of 209.27 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-ethenylethenamine.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-ethenylethenamine
PubChem CID67900326
Molecular FormulaC10H11NO2S
Molecular Weight209.27 g/mol
Exact Mass209.05
IUPAC Name1-(benzenesulfonyl)-N-ethenylethenamine
SMILESC=CNC(=C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C10H11NO2S/c1-3-11-9(2)14(12,13)10-7-5-4-6-8-10/h3-8,11H,1-2H2
InChIKeyMKTAHYZDYPEPOD-UHFFFAOYSA-N
XLogP1.66
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2Z)-2-(benzenesulfonyl)penta-2,4-dienoic acid
CID 90286525
3,3,3-trifluoroprop-1-en-2-ylsulfonylbenzene
CID 10922506
(113C)ethenylsulfonylbenzene
CID 66995821
but-2-en-2-ylsulfonylbenzene
CID 85377514
benzenesulfonic acid;ethenamine
CID 175283513
1-(benzenesulfonyl)hept-6-en-3-ol
CID 164677064
[(3E,5Z)-octa-1,3,5,7-tetraen-3-yl]sulfonylbenzene
CID 134299911
2-(benzenesulfonyl)-1,1-diphenylprop-2-en-1-ol
CID 139779830
N-ethylethanamine;penta-2,4-dien-2-ylsulfonylbenzene
CID 175107138
dimethyl 2-[2-(benzenesulfonyl)prop-2-enyl]propanedioate
CID 10638838
buta-2,3-dien-2-ylsulfonylbenzene
CID 11830311
benzenesulfonyl(phenyl)methanol
CID 174895803

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-ethenylethenamine?
The IUPAC name of 1-(benzenesulfonyl)-N-ethenylethenamine (CID 67900326) is 1-(benzenesulfonyl)-N-ethenylethenamine.
What is the SMILES notation for 1-(benzenesulfonyl)-N-ethenylethenamine?
The canonical SMILES for 1-(benzenesulfonyl)-N-ethenylethenamine is C=CNC(=C)S(=O)(=O)c1ccccc1.
What is the InChIKey of 1-(benzenesulfonyl)-N-ethenylethenamine?
The InChIKey is MKTAHYZDYPEPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2S/c1-3-11-9(2)14(12,13)10-7-5-4-6-8-10/h3-8,11H,1-2H2.
What are the key properties of 1-(benzenesulfonyl)-N-ethenylethenamine?
1-(benzenesulfonyl)-N-ethenylethenamine has a molecular weight of 209.27 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-ethenylethenamine is sourced from PubChem (CID 67900326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).