[4-(4-methoxyquinolin-2-yl)phenyl]methanol

C17H15NO2 — CID 46933322

IUPAC[4-(4-methoxyquinolin-2-yl)phenyl]methanol
SMILESCOc1cc(-c2ccc(CO)cc2)nc2ccccc12
InChIInChI=1S/C17H15NO2/c1-20-17-10-16(13-8-6-12(11-19)7-9-13)18-15-5-3-2-4-14(15)17/h2-10,19H,11H2,1H3
InChIKeyJOCMECTVRDXWIY-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.40
Rot. Bonds3

About [4-(4-methoxyquinolin-2-yl)phenyl]methanol

[4-(4-methoxyquinolin-2-yl)phenyl]methanol (PubChem CID 46933322) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is [4-(4-methoxyquinolin-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(4-methoxyquinolin-2-yl)phenyl]methanol
PubChem CID46933322
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name[4-(4-methoxyquinolin-2-yl)phenyl]methanol
SMILESCOc1cc(-c2ccc(CO)cc2)nc2ccccc12
InChIInChI=1S/C17H15NO2/c1-20-17-10-16(13-8-6-12(11-19)7-9-13)18-15-5-3-2-4-14(15)17/h2-10,19H,11H2,1H3
InChIKeyJOCMECTVRDXWIY-UHFFFAOYSA-N
XLogP3.40
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyquinolin-2-yl)phenyl]methanol?
The IUPAC name of [4-(4-methoxyquinolin-2-yl)phenyl]methanol (CID 46933322) is [4-(4-methoxyquinolin-2-yl)phenyl]methanol.
What is the SMILES notation for [4-(4-methoxyquinolin-2-yl)phenyl]methanol?
The canonical SMILES for [4-(4-methoxyquinolin-2-yl)phenyl]methanol is COc1cc(-c2ccc(CO)cc2)nc2ccccc12.
What is the InChIKey of [4-(4-methoxyquinolin-2-yl)phenyl]methanol?
The InChIKey is JOCMECTVRDXWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-20-17-10-16(13-8-6-12(11-19)7-9-13)18-15-5-3-2-4-14(15)17/h2-10,19H,11H2,1H3.
What are the key properties of [4-(4-methoxyquinolin-2-yl)phenyl]methanol?
[4-(4-methoxyquinolin-2-yl)phenyl]methanol has a molecular weight of 265.31 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyquinolin-2-yl)phenyl]methanol is sourced from PubChem (CID 46933322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).