2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol

C19H16BrNO3 — CID 2966233

IUPAC2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol
SMILESCCOc1cc(C=Cc2ccc3cccc(O)c3n2)c(Br)cc1O
InChIInChI=1S/C19H16BrNO3/c1-2-24-18-10-13(15(20)11-17(18)23)7-9-14-8-6-12-4-3-5-16(22)19(12)21-14/h3-11,22-23H,2H2,1H3
InChIKeyILVNAINEYSGELU-UHFFFAOYSA-N
MW386.25 g/mol
LogP4.98
Rot. Bonds4

About 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol

2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol (PubChem CID 2966233) has the molecular formula C19H16BrNO3 and a molecular weight of 386.25 g/mol. Its IUPAC name is 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol
PubChem CID2966233
Molecular FormulaC19H16BrNO3
Molecular Weight386.25 g/mol
Exact Mass385.03
IUPAC Name2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol
SMILESCCOc1cc(C=Cc2ccc3cccc(O)c3n2)c(Br)cc1O
InChIInChI=1S/C19H16BrNO3/c1-2-24-18-10-13(15(20)11-17(18)23)7-9-14-8-6-12-4-3-5-16(22)19(12)21-14/h3-11,22-23H,2H2,1H3
InChIKeyILVNAINEYSGELU-UHFFFAOYSA-N
XLogP4.98
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.25
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(E)-2-(4-ethoxy-2-fluorophenyl)ethenyl]quinolin-8-ol
CID 141481161
2-[(E)-2-(5-bromo-2-hydroxy-3-methoxyphenyl)ethenyl]quinolin-8-ol
CID 135500758
2-[(Z)-2-(3,5-dibromo-2-hydroxyphenyl)ethenyl]quinolin-8-ol
CID 136765269
2-[2-(2-methoxyphenyl)ethenyl]quinolin-8-ol
CID 2907055
2-[2-(2-methylphenyl)ethenyl]quinolin-8-ol
CID 2922355
2-[2-(2-bromo-4,5-dimethoxyphenyl)ethenyl]-8-nitroquinoline
CID 4815960
2-[(E)-2-[2-(pyridin-2-ylmethoxy)phenyl]ethenyl]quinolin-8-ol
CID 24628167
2-[(E)-2-(2-ethoxyphenyl)ethenyl]-8-nitroquinoline
CID 6214122
2-[2-(3-bromo-4,5-diethoxyphenyl)ethenyl]quinoline
CID 2961249
(2Z)-2-[(2-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]thieno[2,3-b]pyridin-3-one
CID 140897198
N-[(2-bromo-5-ethoxy-4-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide
CID 5191416
2-[2-(3-chlorophenyl)ethenyl]quinolin-8-ol
CID 71412917

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The IUPAC name of 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol (CID 2966233) is 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol.
What is the SMILES notation for 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The canonical SMILES for 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol is CCOc1cc(C=Cc2ccc3cccc(O)c3n2)c(Br)cc1O.
What is the InChIKey of 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol?
The InChIKey is ILVNAINEYSGELU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrNO3/c1-2-24-18-10-13(15(20)11-17(18)23)7-9-14-8-6-12-4-3-5-16(22)19(12)21-14/h3-11,22-23H,2H2,1H3.
What are the key properties of 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol?
2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol has a molecular weight of 386.25 g/mol, XLogP of 4.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-bromo-5-ethoxy-4-hydroxyphenyl)ethenyl]quinolin-8-ol is sourced from PubChem (CID 2966233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).