4-(1-hydroxy-1-quinolin-6-ylethyl)phenol

C17H15NO2 — CID 83076007

IUPAC4-(1-hydroxy-1-quinolin-6-ylethyl)phenol
SMILESCC(O)(c1ccc(O)cc1)c1ccc2ncccc2c1
InChIInChI=1S/C17H15NO2/c1-17(20,13-4-7-15(19)8-5-13)14-6-9-16-12(11-14)3-2-10-18-16/h2-11,19-20H,1H3
InChIKeyYKGRHLFJIRUPIO-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.20
Rot. Bonds2

About 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol

4-(1-hydroxy-1-quinolin-6-ylethyl)phenol (PubChem CID 83076007) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol.

Molecular Properties

Compound Name4-(1-hydroxy-1-quinolin-6-ylethyl)phenol
PubChem CID83076007
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name4-(1-hydroxy-1-quinolin-6-ylethyl)phenol
SMILESCC(O)(c1ccc(O)cc1)c1ccc2ncccc2c1
InChIInChI=1S/C17H15NO2/c1-17(20,13-4-7-15(19)8-5-13)14-6-9-16-12(11-14)3-2-10-18-16/h2-11,19-20H,1H3
InChIKeyYKGRHLFJIRUPIO-UHFFFAOYSA-N
XLogP3.20
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-1-quinolin-6-ylethanol
CID 81216254
1-(3-fluoro-4-methylphenyl)-1-quinolin-6-ylethanol
CID 81198431
3-(1-hydroxy-1-quinolin-6-ylethyl)benzonitrile
CID 115481316
1-(2-fluorophenyl)-1-quinolin-6-ylethanol
CID 81215960
6-tert-butylquinoline;7-tert-butylquinoline
CID 159076219
tetrakis(benzene-1,4-diol);quinoline
CID 174523855
2-quinolin-6-ylheptan-2-ol
CID 81215851
6-(2-methylsulfonylpropan-2-yl)quinoline
CID 91258076
2-methyl-2-quinolin-6-ylpropanehydrazide
CID 66927115
2-methyl-3-quinolin-6-ylpentan-3-ol
CID 81215889
2-fluoro-1-phenyl-2-quinolin-6-ylpropan-1-one
CID 170553040
6-tert-butyl-2-methylquinoxaline;3-tert-butyl-1,5-naphthyridine;6-tert-butylquinoline;6-tert-butylquinoxaline
CID 157191671

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol?
The IUPAC name of 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol (CID 83076007) is 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol.
What is the SMILES notation for 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol?
The canonical SMILES for 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol is CC(O)(c1ccc(O)cc1)c1ccc2ncccc2c1.
What is the InChIKey of 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol?
The InChIKey is YKGRHLFJIRUPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-17(20,13-4-7-15(19)8-5-13)14-6-9-16-12(11-14)3-2-10-18-16/h2-11,19-20H,1H3.
What are the key properties of 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol?
4-(1-hydroxy-1-quinolin-6-ylethyl)phenol has a molecular weight of 265.31 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxy-1-quinolin-6-ylethyl)phenol is sourced from PubChem (CID 83076007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).