1-(3-methoxyquinolin-5-yl)ethanol

C12H13NO2 — CID 141175761

IUPAC1-(3-methoxyquinolin-5-yl)ethanol
SMILESCOc1cnc2cccc(C(C)O)c2c1
InChIInChI=1S/C12H13NO2/c1-8(14)10-4-3-5-12-11(10)6-9(15-2)7-13-12/h3-8,14H,1-2H3
InChIKeyWQHKEJBYWRLKTH-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.30
Rot. Bonds2

About 1-(3-methoxyquinolin-5-yl)ethanol

1-(3-methoxyquinolin-5-yl)ethanol (PubChem CID 141175761) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 1-(3-methoxyquinolin-5-yl)ethanol.

Molecular Properties

Compound Name1-(3-methoxyquinolin-5-yl)ethanol
PubChem CID141175761
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name1-(3-methoxyquinolin-5-yl)ethanol
SMILESCOc1cnc2cccc(C(C)O)c2c1
InChIInChI=1S/C12H13NO2/c1-8(14)10-4-3-5-12-11(10)6-9(15-2)7-13-12/h3-8,14H,1-2H3
InChIKeyWQHKEJBYWRLKTH-UHFFFAOYSA-N
XLogP2.30
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyquinolin-5-yl)ethanol?
The IUPAC name of 1-(3-methoxyquinolin-5-yl)ethanol (CID 141175761) is 1-(3-methoxyquinolin-5-yl)ethanol.
What is the SMILES notation for 1-(3-methoxyquinolin-5-yl)ethanol?
The canonical SMILES for 1-(3-methoxyquinolin-5-yl)ethanol is COc1cnc2cccc(C(C)O)c2c1.
What is the InChIKey of 1-(3-methoxyquinolin-5-yl)ethanol?
The InChIKey is WQHKEJBYWRLKTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-8(14)10-4-3-5-12-11(10)6-9(15-2)7-13-12/h3-8,14H,1-2H3.
What are the key properties of 1-(3-methoxyquinolin-5-yl)ethanol?
1-(3-methoxyquinolin-5-yl)ethanol has a molecular weight of 203.24 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyquinolin-5-yl)ethanol is sourced from PubChem (CID 141175761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).