(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide

C15H16N2O2S — CID 2103374

IUPAC(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)NCCc1ccccn1
InChIInChI=1S/C15H16N2O2S/c18-20(19,13-10-14-6-2-1-3-7-14)17-12-9-15-8-4-5-11-16-15/h1-8,10-11,13,17H,9,12H2/b13-10+
InChIKeyHHCIQOTTXHHMFI-JLHYYAGUSA-N
MW288.37 g/mol
LogP2.21
Rot. Bonds6

About (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide

(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide (PubChem CID 2103374) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide
PubChem CID2103374
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccccc1)NCCc1ccccn1
InChIInChI=1S/C15H16N2O2S/c18-20(19,13-10-14-6-2-1-3-7-14)17-12-9-15-8-4-5-11-16-15/h1-8,10-11,13,17H,9,12H2/b13-10+
InChIKeyHHCIQOTTXHHMFI-JLHYYAGUSA-N
XLogP2.21
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide?
The IUPAC name of (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide (CID 2103374) is (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide.
What is the SMILES notation for (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide?
The canonical SMILES for (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide is O=S(=O)(/C=C/c1ccccc1)NCCc1ccccn1.
What is the InChIKey of (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide?
The InChIKey is HHCIQOTTXHHMFI-JLHYYAGUSA-N. The full InChI is InChI=1S/C15H16N2O2S/c18-20(19,13-10-14-6-2-1-3-7-14)17-12-9-15-8-4-5-11-16-15/h1-8,10-11,13,17H,9,12H2/b13-10+.
What are the key properties of (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide?
(E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide has a molecular weight of 288.37 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-phenyl-N-(2-pyridin-2-ylethyl)ethenesulfonamide is sourced from PubChem (CID 2103374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).