3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine

C19H15NO2S — CID 169237898

IUPAC3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine
SMILESO=S(=O)(/C(=C\c1ccccc1)c1cccnc1)c1ccccc1
InChIInChI=1S/C19H15NO2S/c21-23(22,18-11-5-2-6-12-18)19(17-10-7-13-20-15-17)14-16-8-3-1-4-9-16/h1-15H/b19-14-
InChIKeyMXIQZYGBOYYBAQ-RGEXLXHISA-N
MW321.40 g/mol
LogP4.05
Rot. Bonds4

About 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine

3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine (PubChem CID 169237898) has the molecular formula C19H15NO2S and a molecular weight of 321.40 g/mol. Its IUPAC name is 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine.

Molecular Properties

Compound Name3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine
PubChem CID169237898
Molecular FormulaC19H15NO2S
Molecular Weight321.40 g/mol
Exact Mass321.08
IUPAC Name3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine
SMILESO=S(=O)(/C(=C\c1ccccc1)c1cccnc1)c1ccccc1
InChIInChI=1S/C19H15NO2S/c21-23(22,18-11-5-2-6-12-18)19(17-10-7-13-20-15-17)14-16-8-3-1-4-9-16/h1-15H/b19-14-
InChIKeyMXIQZYGBOYYBAQ-RGEXLXHISA-N
XLogP4.05
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

benzenesulfonic acid;pyridine-3-carboxamide
CID 157114692
1-phenyl-2-pyridin-3-ylethane-1,2-dione
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3-[(E)-2-(benzenesulfonyl)ethenyl]pyridine
CID 11817425
(E)-1-phenyl-3-pyridin-3-ylprop-2-en-1-one
CID 5354062
1,2-diphenylethenesulfonamide
CID 54513105
[(Z)-2-(benzenesulfonyl)-2-fluoroethenyl]benzene
CID 134986797
[(Z)-2-(benzenesulfonyl)prop-1-enyl]benzene
CID 5382420
3-[(Z)-2-fluoro-2-phenylethenyl]pyridine
CID 141385895
acetic acid;copper;bis((E)-3-phenyl-1-pyridin-3-ylprop-2-en-1-one)
CID 134081608
3-(benzenesulfonyl)pyridine
CID 5147032
(Z)-2-(benzenesulfonyl)-3-phenylprop-2-enoic acid
CID 10565275
N-[(E)-1-(benzenesulfonyl)-2-phenylethenyl]benzenecarboximidoyl chloride
CID 39878568

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine?
The IUPAC name of 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine (CID 169237898) is 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine.
What is the SMILES notation for 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine?
The canonical SMILES for 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine is O=S(=O)(/C(=C\c1ccccc1)c1cccnc1)c1ccccc1.
What is the InChIKey of 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine?
The InChIKey is MXIQZYGBOYYBAQ-RGEXLXHISA-N. The full InChI is InChI=1S/C19H15NO2S/c21-23(22,18-11-5-2-6-12-18)19(17-10-7-13-20-15-17)14-16-8-3-1-4-9-16/h1-15H/b19-14-.
What are the key properties of 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine?
3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine has a molecular weight of 321.40 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine is sourced from PubChem (CID 169237898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).