7-fluoro-3-pyridin-3-ylisoquinoline

C14H9FN2 — CID 25058388

IUPAC7-fluoro-3-pyridin-3-ylisoquinoline
SMILESFc1ccc2cc(-c3cccnc3)ncc2c1
InChIInChI=1S/C14H9FN2/c15-13-4-3-10-7-14(17-9-12(10)6-13)11-2-1-5-16-8-11/h1-9H
InChIKeyRIQSIVMYVSCMGG-UHFFFAOYSA-N
MW224.24 g/mol
LogP3.44
Rot. Bonds1

About 7-fluoro-3-pyridin-3-ylisoquinoline

7-fluoro-3-pyridin-3-ylisoquinoline (PubChem CID 25058388) has the molecular formula C14H9FN2 and a molecular weight of 224.24 g/mol. Its IUPAC name is 7-fluoro-3-pyridin-3-ylisoquinoline.

Molecular Properties

Compound Name7-fluoro-3-pyridin-3-ylisoquinoline
PubChem CID25058388
Molecular FormulaC14H9FN2
Molecular Weight224.24 g/mol
Exact Mass224.07
IUPAC Name7-fluoro-3-pyridin-3-ylisoquinoline
SMILESFc1ccc2cc(-c3cccnc3)ncc2c1
InChIInChI=1S/C14H9FN2/c15-13-4-3-10-7-14(17-9-12(10)6-13)11-2-1-5-16-8-11/h1-9H
InChIKeyRIQSIVMYVSCMGG-UHFFFAOYSA-N
XLogP3.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-pyridin-3-ylisoquinoline?
The IUPAC name of 7-fluoro-3-pyridin-3-ylisoquinoline (CID 25058388) is 7-fluoro-3-pyridin-3-ylisoquinoline.
What is the SMILES notation for 7-fluoro-3-pyridin-3-ylisoquinoline?
The canonical SMILES for 7-fluoro-3-pyridin-3-ylisoquinoline is Fc1ccc2cc(-c3cccnc3)ncc2c1.
What is the InChIKey of 7-fluoro-3-pyridin-3-ylisoquinoline?
The InChIKey is RIQSIVMYVSCMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2/c15-13-4-3-10-7-14(17-9-12(10)6-13)11-2-1-5-16-8-11/h1-9H.
What are the key properties of 7-fluoro-3-pyridin-3-ylisoquinoline?
7-fluoro-3-pyridin-3-ylisoquinoline has a molecular weight of 224.24 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-pyridin-3-ylisoquinoline is sourced from PubChem (CID 25058388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).