7-fluoro-2-(oxan-3-yl)quinolin-3-ol

C14H14FNO2 — CID 165476620

IUPAC7-fluoro-2-(oxan-3-yl)quinolin-3-ol
SMILESOc1cc2ccc(F)cc2nc1C1CCCOC1
InChIInChI=1S/C14H14FNO2/c15-11-4-3-9-6-13(17)14(16-12(9)7-11)10-2-1-5-18-8-10/h3-4,6-7,10,17H,1-2,5,8H2
InChIKeyZNPKISPJSAEAPU-UHFFFAOYSA-N
MW247.27 g/mol
LogP2.97
Rot. Bonds1

About 7-fluoro-2-(oxan-3-yl)quinolin-3-ol

7-fluoro-2-(oxan-3-yl)quinolin-3-ol (PubChem CID 165476620) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is 7-fluoro-2-(oxan-3-yl)quinolin-3-ol.

Molecular Properties

Compound Name7-fluoro-2-(oxan-3-yl)quinolin-3-ol
PubChem CID165476620
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name7-fluoro-2-(oxan-3-yl)quinolin-3-ol
SMILESOc1cc2ccc(F)cc2nc1C1CCCOC1
InChIInChI=1S/C14H14FNO2/c15-11-4-3-9-6-13(17)14(16-12(9)7-11)10-2-1-5-18-8-10/h3-4,6-7,10,17H,1-2,5,8H2
InChIKeyZNPKISPJSAEAPU-UHFFFAOYSA-N
XLogP2.97
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-(oxan-3-yl)quinolin-3-ol?
The IUPAC name of 7-fluoro-2-(oxan-3-yl)quinolin-3-ol (CID 165476620) is 7-fluoro-2-(oxan-3-yl)quinolin-3-ol.
What is the SMILES notation for 7-fluoro-2-(oxan-3-yl)quinolin-3-ol?
The canonical SMILES for 7-fluoro-2-(oxan-3-yl)quinolin-3-ol is Oc1cc2ccc(F)cc2nc1C1CCCOC1.
What is the InChIKey of 7-fluoro-2-(oxan-3-yl)quinolin-3-ol?
The InChIKey is ZNPKISPJSAEAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2/c15-11-4-3-9-6-13(17)14(16-12(9)7-11)10-2-1-5-18-8-10/h3-4,6-7,10,17H,1-2,5,8H2.
What are the key properties of 7-fluoro-2-(oxan-3-yl)quinolin-3-ol?
7-fluoro-2-(oxan-3-yl)quinolin-3-ol has a molecular weight of 247.27 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-(oxan-3-yl)quinolin-3-ol is sourced from PubChem (CID 165476620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).