5-(6-methoxyquinolin-4-yl)-2-methylphenol

C17H15NO2 — CID 70854482

IUPAC5-(6-methoxyquinolin-4-yl)-2-methylphenol
SMILESCOc1ccc2nccc(-c3ccc(C)c(O)c3)c2c1
InChIInChI=1S/C17H15NO2/c1-11-3-4-12(9-17(11)19)14-7-8-18-16-6-5-13(20-2)10-15(14)16/h3-10,19H,1-2H3
InChIKeyLDHJCUXFVJFXGR-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.92
Rot. Bonds2

About 5-(6-methoxyquinolin-4-yl)-2-methylphenol

5-(6-methoxyquinolin-4-yl)-2-methylphenol (PubChem CID 70854482) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-(6-methoxyquinolin-4-yl)-2-methylphenol.

Molecular Properties

Compound Name5-(6-methoxyquinolin-4-yl)-2-methylphenol
PubChem CID70854482
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name5-(6-methoxyquinolin-4-yl)-2-methylphenol
SMILESCOc1ccc2nccc(-c3ccc(C)c(O)c3)c2c1
InChIInChI=1S/C17H15NO2/c1-11-3-4-12(9-17(11)19)14-7-8-18-16-6-5-13(20-2)10-15(14)16/h3-10,19H,1-2H3
InChIKeyLDHJCUXFVJFXGR-UHFFFAOYSA-N
XLogP3.92
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methanesulfonic acid;4-(7-methoxyquinolin-4-yl)-2-methylphenol
CID 170169423
6-methoxy-4-(1H-pyrazol-4-yl)quinoline
CID 67260724
2-methoxy-5-[6-(trifluoromethyl)quinolin-4-yl]phenol
CID 66559034
ethyl formate;6-methoxy-4-phenylquinoline
CID 161481993
5-(3-methoxyphenyl)-2-methylphenol
CID 53218836
bis[4-(7-methoxyquinolin-4-yl)-2-methylphenyl] propanedioate
CID 175394062
4-tert-butyl-6-methoxyquinoline
CID 58989607
2-methoxy-5-[6-methoxy-7-(trifluoromethyl)quinolin-4-yl]phenol
CID 66559035
azane;6-methoxyquinoline-4-carboxylic acid
CID 67151937
6-methoxyquinoline-4-sulfonic acid
CID 119093175
ethane;O-(6-methoxyquinolin-4-yl)hydroxylamine
CID 157043543
4-amino-6-methoxyquinolin-3-ol
CID 84662489

Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxyquinolin-4-yl)-2-methylphenol?
The IUPAC name of 5-(6-methoxyquinolin-4-yl)-2-methylphenol (CID 70854482) is 5-(6-methoxyquinolin-4-yl)-2-methylphenol.
What is the SMILES notation for 5-(6-methoxyquinolin-4-yl)-2-methylphenol?
The canonical SMILES for 5-(6-methoxyquinolin-4-yl)-2-methylphenol is COc1ccc2nccc(-c3ccc(C)c(O)c3)c2c1.
What is the InChIKey of 5-(6-methoxyquinolin-4-yl)-2-methylphenol?
The InChIKey is LDHJCUXFVJFXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-11-3-4-12(9-17(11)19)14-7-8-18-16-6-5-13(20-2)10-15(14)16/h3-10,19H,1-2H3.
What are the key properties of 5-(6-methoxyquinolin-4-yl)-2-methylphenol?
5-(6-methoxyquinolin-4-yl)-2-methylphenol has a molecular weight of 265.31 g/mol, XLogP of 3.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxyquinolin-4-yl)-2-methylphenol is sourced from PubChem (CID 70854482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).