5-chloro-7-fluoroquinolin-8-ol

C9H5ClFNO — CID 23083829

IUPAC5-chloro-7-fluoroquinolin-8-ol
SMILESOc1c(F)cc(Cl)c2cccnc12
InChIInChI=1S/C9H5ClFNO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKeyNJRFGEVCJFLFSV-UHFFFAOYSA-N
MW197.60 g/mol
LogP2.73
Rot. Bonds

About 5-chloro-7-fluoroquinolin-8-ol

5-chloro-7-fluoroquinolin-8-ol (PubChem CID 23083829) has the molecular formula C9H5ClFNO and a molecular weight of 197.60 g/mol. Its IUPAC name is 5-chloro-7-fluoroquinolin-8-ol.

Molecular Properties

Compound Name5-chloro-7-fluoroquinolin-8-ol
PubChem CID23083829
Molecular FormulaC9H5ClFNO
Molecular Weight197.60 g/mol
Exact Mass197.00
IUPAC Name5-chloro-7-fluoroquinolin-8-ol
SMILESOc1c(F)cc(Cl)c2cccnc12
InChIInChI=1S/C9H5ClFNO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKeyNJRFGEVCJFLFSV-UHFFFAOYSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.60
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-fluoroquinolin-8-ol?
The IUPAC name of 5-chloro-7-fluoroquinolin-8-ol (CID 23083829) is 5-chloro-7-fluoroquinolin-8-ol.
What is the SMILES notation for 5-chloro-7-fluoroquinolin-8-ol?
The canonical SMILES for 5-chloro-7-fluoroquinolin-8-ol is Oc1c(F)cc(Cl)c2cccnc12.
What is the InChIKey of 5-chloro-7-fluoroquinolin-8-ol?
The InChIKey is NJRFGEVCJFLFSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClFNO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H.
What are the key properties of 5-chloro-7-fluoroquinolin-8-ol?
5-chloro-7-fluoroquinolin-8-ol has a molecular weight of 197.60 g/mol, XLogP of 2.73, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-fluoroquinolin-8-ol is sourced from PubChem (CID 23083829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).