4-(6,7-dimethoxyquinolin-3-yl)phenol

C17H15NO3 — CID 11778467

IUPAC4-(6,7-dimethoxyquinolin-3-yl)phenol
SMILESCOc1cc2cc(-c3ccc(O)cc3)cnc2cc1OC
InChIInChI=1S/C17H15NO3/c1-20-16-8-12-7-13(11-3-5-14(19)6-4-11)10-18-15(12)9-17(16)21-2/h3-10,19H,1-2H3
InChIKeyGVQYSEHILFQSHO-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.62
Rot. Bonds3

About 4-(6,7-dimethoxyquinolin-3-yl)phenol

4-(6,7-dimethoxyquinolin-3-yl)phenol (PubChem CID 11778467) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 4-(6,7-dimethoxyquinolin-3-yl)phenol.

Molecular Properties

Compound Name4-(6,7-dimethoxyquinolin-3-yl)phenol
PubChem CID11778467
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name4-(6,7-dimethoxyquinolin-3-yl)phenol
SMILESCOc1cc2cc(-c3ccc(O)cc3)cnc2cc1OC
InChIInChI=1S/C17H15NO3/c1-20-16-8-12-7-13(11-3-5-14(19)6-4-11)10-18-15(12)9-17(16)21-2/h3-10,19H,1-2H3
InChIKeyGVQYSEHILFQSHO-UHFFFAOYSA-N
XLogP3.62
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(6,7-dimethoxyquinolin-3-yl)phenol?
The IUPAC name of 4-(6,7-dimethoxyquinolin-3-yl)phenol (CID 11778467) is 4-(6,7-dimethoxyquinolin-3-yl)phenol.
What is the SMILES notation for 4-(6,7-dimethoxyquinolin-3-yl)phenol?
The canonical SMILES for 4-(6,7-dimethoxyquinolin-3-yl)phenol is COc1cc2cc(-c3ccc(O)cc3)cnc2cc1OC.
What is the InChIKey of 4-(6,7-dimethoxyquinolin-3-yl)phenol?
The InChIKey is GVQYSEHILFQSHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-20-16-8-12-7-13(11-3-5-14(19)6-4-11)10-18-15(12)9-17(16)21-2/h3-10,19H,1-2H3.
What are the key properties of 4-(6,7-dimethoxyquinolin-3-yl)phenol?
4-(6,7-dimethoxyquinolin-3-yl)phenol has a molecular weight of 281.31 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,7-dimethoxyquinolin-3-yl)phenol is sourced from PubChem (CID 11778467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).