5-fluoro-3-thiophen-3-ylquinoline

C13H8FNS — CID 10421346

IUPAC5-fluoro-3-thiophen-3-ylquinoline
SMILESFc1cccc2ncc(-c3ccsc3)cc12
InChIInChI=1S/C13H8FNS/c14-12-2-1-3-13-11(12)6-10(7-15-13)9-4-5-16-8-9/h1-8H
InChIKeyBEVNNTNJJJWQAK-UHFFFAOYSA-N
MW229.28 g/mol
LogP4.10
Rot. Bonds1

About 5-fluoro-3-thiophen-3-ylquinoline

5-fluoro-3-thiophen-3-ylquinoline (PubChem CID 10421346) has the molecular formula C13H8FNS and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-fluoro-3-thiophen-3-ylquinoline.

Molecular Properties

Compound Name5-fluoro-3-thiophen-3-ylquinoline
PubChem CID10421346
Molecular FormulaC13H8FNS
Molecular Weight229.28 g/mol
Exact Mass229.04
IUPAC Name5-fluoro-3-thiophen-3-ylquinoline
SMILESFc1cccc2ncc(-c3ccsc3)cc12
InChIInChI=1S/C13H8FNS/c14-12-2-1-3-13-11(12)6-10(7-15-13)9-4-5-16-8-9/h1-8H
InChIKeyBEVNNTNJJJWQAK-UHFFFAOYSA-N
XLogP4.10
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-thiophen-3-ylquinoline?
The IUPAC name of 5-fluoro-3-thiophen-3-ylquinoline (CID 10421346) is 5-fluoro-3-thiophen-3-ylquinoline.
What is the SMILES notation for 5-fluoro-3-thiophen-3-ylquinoline?
The canonical SMILES for 5-fluoro-3-thiophen-3-ylquinoline is Fc1cccc2ncc(-c3ccsc3)cc12.
What is the InChIKey of 5-fluoro-3-thiophen-3-ylquinoline?
The InChIKey is BEVNNTNJJJWQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FNS/c14-12-2-1-3-13-11(12)6-10(7-15-13)9-4-5-16-8-9/h1-8H.
What are the key properties of 5-fluoro-3-thiophen-3-ylquinoline?
5-fluoro-3-thiophen-3-ylquinoline has a molecular weight of 229.28 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-thiophen-3-ylquinoline is sourced from PubChem (CID 10421346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).