2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol

C19H16FNO2 — CID 141481161

IUPAC2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol
SMILESCCOc1ccc(/C=C/c2ccc3cccc(O)c3n2)c(F)c1
InChIInChI=1S/C19H16FNO2/c1-2-23-16-11-8-13(17(20)12-16)6-9-15-10-7-14-4-3-5-18(22)19(14)21-15/h3-12,22H,2H2,1H3/b9-6+
InChIKeyZXMSQPXGFPPSKK-RMKNXTFCSA-N
MW309.34 g/mol
LogP4.65
Rot. Bonds4

About 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol

2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol (PubChem CID 141481161) has the molecular formula C19H16FNO2 and a molecular weight of 309.34 g/mol. Its IUPAC name is 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol
PubChem CID141481161
Molecular FormulaC19H16FNO2
Molecular Weight309.34 g/mol
Exact Mass309.12
IUPAC Name2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol
SMILESCCOc1ccc(/C=C/c2ccc3cccc(O)c3n2)c(F)c1
InChIInChI=1S/C19H16FNO2/c1-2-23-16-11-8-13(17(20)12-16)6-9-15-10-7-14-4-3-5-18(22)19(14)21-15/h3-12,22H,2H2,1H3/b9-6+
InChIKeyZXMSQPXGFPPSKK-RMKNXTFCSA-N
XLogP4.65
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.34
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol
CID 2966233
2-[2-(2-methylphenyl)ethenyl]quinolin-8-ol
CID 2922355
2-[2-(2-methoxyphenyl)ethenyl]quinolin-8-ol
CID 2907055
2-[(Z)-2-(3,5-dibromo-2-hydroxyphenyl)ethenyl]quinolin-8-ol
CID 136765269
3-(4-ethoxy-2-fluorophenyl)prop-2-en-1-amine
CID 169463810
2-[(E)-2-(5-bromo-2-hydroxy-3-methoxyphenyl)ethenyl]quinolin-8-ol
CID 135500758
4-(4-ethoxy-2-fluorophenyl)but-3-ene-1-thiol
CID 170478614
2-ethoxynaphthalene
CID 118978197
4-(4-ethoxy-2-fluorophenyl)but-3-enenitrile
CID 170799973
2-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]quinolin-8-ol chloride
CID 135534383
2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol
CID 24628167
6-ethoxy-3-fluoroquinoline
CID 90101959

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol?
The IUPAC name of 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol (CID 141481161) is 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol.
What is the SMILES notation for 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol?
The canonical SMILES for 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol is CCOc1ccc(/C=C/c2ccc3cccc(O)c3n2)c(F)c1.
What is the InChIKey of 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol?
The InChIKey is ZXMSQPXGFPPSKK-RMKNXTFCSA-N. The full InChI is InChI=1S/C19H16FNO2/c1-2-23-16-11-8-13(17(20)12-16)6-9-15-10-7-14-4-3-5-18(22)19(14)21-15/h3-12,22H,2H2,1H3/b9-6+.
What are the key properties of 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol?
2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol has a molecular weight of 309.34 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol is sourced from PubChem (CID 141481161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).