2-quinolin-2-ylphenol

C15H11NO — CID 135501783

IUPAC2-quinolin-2-ylphenol
SMILESOc1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C15H11NO/c17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H
InChIKeyJUMVYDGWHJBSIT-UHFFFAOYSA-N
MW221.26 g/mol
LogP3.61
Rot. Bonds1

About 2-quinolin-2-ylphenol

2-quinolin-2-ylphenol (PubChem CID 135501783) has the molecular formula C15H11NO and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-quinolin-2-ylphenol.

Molecular Properties

Compound Name2-quinolin-2-ylphenol
PubChem CID135501783
Molecular FormulaC15H11NO
Molecular Weight221.26 g/mol
Exact Mass221.08
IUPAC Name2-quinolin-2-ylphenol
SMILESOc1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C15H11NO/c17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H
InChIKeyJUMVYDGWHJBSIT-UHFFFAOYSA-N
XLogP3.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-quinolin-2-ylphenol?
The IUPAC name of 2-quinolin-2-ylphenol (CID 135501783) is 2-quinolin-2-ylphenol.
What is the SMILES notation for 2-quinolin-2-ylphenol?
The canonical SMILES for 2-quinolin-2-ylphenol is Oc1ccccc1-c1ccc2ccccc2n1.
What is the InChIKey of 2-quinolin-2-ylphenol?
The InChIKey is JUMVYDGWHJBSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO/c17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H.
What are the key properties of 2-quinolin-2-ylphenol?
2-quinolin-2-ylphenol has a molecular weight of 221.26 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-2-ylphenol is sourced from PubChem (CID 135501783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).