4-(6-chloro-5-fluoroquinolin-8-yl)phenol

C15H9ClFNO — CID 170436499

IUPAC4-(6-chloro-5-fluoroquinolin-8-yl)phenol
SMILESOc1ccc(-c2cc(Cl)c(F)c3cccnc23)cc1
InChIInChI=1S/C15H9ClFNO/c16-13-8-12(9-3-5-10(19)6-4-9)15-11(14(13)17)2-1-7-18-15/h1-8,19H
InChIKeyILJMOEQWMNYOKG-UHFFFAOYSA-N
MW273.69 g/mol
LogP4.40
Rot. Bonds1

About 4-(6-chloro-5-fluoroquinolin-8-yl)phenol

4-(6-chloro-5-fluoroquinolin-8-yl)phenol (PubChem CID 170436499) has the molecular formula C15H9ClFNO and a molecular weight of 273.69 g/mol. Its IUPAC name is 4-(6-chloro-5-fluoroquinolin-8-yl)phenol.

Molecular Properties

Compound Name4-(6-chloro-5-fluoroquinolin-8-yl)phenol
PubChem CID170436499
Molecular FormulaC15H9ClFNO
Molecular Weight273.69 g/mol
Exact Mass273.04
IUPAC Name4-(6-chloro-5-fluoroquinolin-8-yl)phenol
SMILESOc1ccc(-c2cc(Cl)c(F)c3cccnc23)cc1
InChIInChI=1S/C15H9ClFNO/c16-13-8-12(9-3-5-10(19)6-4-9)15-11(14(13)17)2-1-7-18-15/h1-8,19H
InChIKeyILJMOEQWMNYOKG-UHFFFAOYSA-N
XLogP4.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.69
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

zinc 5-chloro-7-(18F)fluoroquinolin-8-ol
CID 10378005
4-(4-methylquinolin-8-yl)phenol
CID 70813366
5-chloro-6-fluoroquinolin-8-ol
CID 166150236
7-chloro-5-(5-hydroxy-1-benzofuran-2-yl)quinolin-8-ol
CID 127037472
5,7-dichloroquinolin-8-ol;nickel
CID 175096460
4-thieno[2,3-b]pyridin-3-ylphenol
CID 139624317
8-chloro-5-fluoroquinoline
CID 53435993
4-(4-chloro-2-fluorophenyl)phenol
CID 83128689
CID 172791001
CID 172791001
3-(8-chloroquinolin-4-yl)phenol
CID 68878761
bis(5-chloro-7-iodoquinolin-8-ol);indium-111(3+)
CID 25009411
bis(5-chloro-7-iodoquinolin-8-ol);gallium-67(3+)
CID 25009413

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-5-fluoroquinolin-8-yl)phenol?
The IUPAC name of 4-(6-chloro-5-fluoroquinolin-8-yl)phenol (CID 170436499) is 4-(6-chloro-5-fluoroquinolin-8-yl)phenol.
What is the SMILES notation for 4-(6-chloro-5-fluoroquinolin-8-yl)phenol?
The canonical SMILES for 4-(6-chloro-5-fluoroquinolin-8-yl)phenol is Oc1ccc(-c2cc(Cl)c(F)c3cccnc23)cc1.
What is the InChIKey of 4-(6-chloro-5-fluoroquinolin-8-yl)phenol?
The InChIKey is ILJMOEQWMNYOKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFNO/c16-13-8-12(9-3-5-10(19)6-4-9)15-11(14(13)17)2-1-7-18-15/h1-8,19H.
What are the key properties of 4-(6-chloro-5-fluoroquinolin-8-yl)phenol?
4-(6-chloro-5-fluoroquinolin-8-yl)phenol has a molecular weight of 273.69 g/mol, XLogP of 4.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-5-fluoroquinolin-8-yl)phenol is sourced from PubChem (CID 170436499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).