2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol

C20H16N2O2 — CID 15456008

IUPAC2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol
SMILESOc1cccc2ccc(CCc3ccc4cccc(O)c4n3)nc12
InChIInChI=1S/C20H16N2O2/c23-17-5-1-3-13-7-9-15(21-19(13)17)11-12-16-10-8-14-4-2-6-18(24)20(14)22-16/h1-10,23-24H,11-12H2
InChIKeyOKCULIMOMSXPBQ-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.98
Rot. Bonds3

About 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol

2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol (PubChem CID 15456008) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol.

Molecular Properties

Compound Name2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol
PubChem CID15456008
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol
SMILESOc1cccc2ccc(CCc3ccc4cccc(O)c4n3)nc12
InChIInChI=1S/C20H16N2O2/c23-17-5-1-3-13-7-9-15(21-19(13)17)11-12-16-10-8-14-4-2-6-18(24)20(14)22-16/h1-10,23-24H,11-12H2
InChIKeyOKCULIMOMSXPBQ-UHFFFAOYSA-N
XLogP3.98
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol?
The IUPAC name of 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol (CID 15456008) is 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol.
What is the SMILES notation for 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol?
The canonical SMILES for 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol is Oc1cccc2ccc(CCc3ccc4cccc(O)c4n3)nc12.
What is the InChIKey of 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol?
The InChIKey is OKCULIMOMSXPBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-17-5-1-3-13-7-9-15(21-19(13)17)11-12-16-10-8-14-4-2-6-18(24)20(14)22-16/h1-10,23-24H,11-12H2.
What are the key properties of 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol?
2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol has a molecular weight of 316.36 g/mol, XLogP of 3.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(8-hydroxyquinolin-2-yl)ethyl]quinolin-8-ol is sourced from PubChem (CID 15456008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).