8-fluoro-3-(2-methylphenoxy)quinoline

C16H12FNO — CID 135371056

IUPAC8-fluoro-3-(2-methylphenoxy)quinoline
SMILESCc1ccccc1Oc1cnc2c(F)cccc2c1
InChIInChI=1S/C16H12FNO/c1-11-5-2-3-8-15(11)19-13-9-12-6-4-7-14(17)16(12)18-10-13/h2-10H,1H3
InChIKeyKJSARGKCRISBAA-UHFFFAOYSA-N
MW253.28 g/mol
LogP4.47
Rot. Bonds2

About 8-fluoro-3-(2-methylphenoxy)quinoline

8-fluoro-3-(2-methylphenoxy)quinoline (PubChem CID 135371056) has the molecular formula C16H12FNO and a molecular weight of 253.28 g/mol. Its IUPAC name is 8-fluoro-3-(2-methylphenoxy)quinoline.

Molecular Properties

Compound Name8-fluoro-3-(2-methylphenoxy)quinoline
PubChem CID135371056
Molecular FormulaC16H12FNO
Molecular Weight253.28 g/mol
Exact Mass253.09
IUPAC Name8-fluoro-3-(2-methylphenoxy)quinoline
SMILESCc1ccccc1Oc1cnc2c(F)cccc2c1
InChIInChI=1S/C16H12FNO/c1-11-5-2-3-8-15(11)19-13-9-12-6-4-7-14(17)16(12)18-10-13/h2-10H,1H3
InChIKeyKJSARGKCRISBAA-UHFFFAOYSA-N
XLogP4.47
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-3-(2-methylphenoxy)quinoline?
The IUPAC name of 8-fluoro-3-(2-methylphenoxy)quinoline (CID 135371056) is 8-fluoro-3-(2-methylphenoxy)quinoline.
What is the SMILES notation for 8-fluoro-3-(2-methylphenoxy)quinoline?
The canonical SMILES for 8-fluoro-3-(2-methylphenoxy)quinoline is Cc1ccccc1Oc1cnc2c(F)cccc2c1.
What is the InChIKey of 8-fluoro-3-(2-methylphenoxy)quinoline?
The InChIKey is KJSARGKCRISBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO/c1-11-5-2-3-8-15(11)19-13-9-12-6-4-7-14(17)16(12)18-10-13/h2-10H,1H3.
What are the key properties of 8-fluoro-3-(2-methylphenoxy)quinoline?
8-fluoro-3-(2-methylphenoxy)quinoline has a molecular weight of 253.28 g/mol, XLogP of 4.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-3-(2-methylphenoxy)quinoline is sourced from PubChem (CID 135371056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).