5-fluoro-2H-thiopyran

C5H5FS — CID 123673076

IUPAC5-fluoro-2H-thiopyran
SMILESFC1=CSCC=C1
InChIInChI=1S/C5H5FS/c6-5-2-1-3-7-4-5/h1-2,4H,3H2
InChIKeyGVDJTHKYALPZIU-UHFFFAOYSA-N
MW116.16 g/mol
LogP2.10
Rot. Bonds

About 5-fluoro-2H-thiopyran

5-fluoro-2H-thiopyran (PubChem CID 123673076) has the molecular formula C5H5FS and a molecular weight of 116.16 g/mol. Its IUPAC name is 5-fluoro-2H-thiopyran.

Molecular Properties

Compound Name5-fluoro-2H-thiopyran
PubChem CID123673076
Molecular FormulaC5H5FS
Molecular Weight116.16 g/mol
Exact Mass116.01
IUPAC Name5-fluoro-2H-thiopyran
SMILESFC1=CSCC=C1
InChIInChI=1S/C5H5FS/c6-5-2-1-3-7-4-5/h1-2,4H,3H2
InChIKeyGVDJTHKYALPZIU-UHFFFAOYSA-N
XLogP2.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2H-thiopyran?
The IUPAC name of 5-fluoro-2H-thiopyran (CID 123673076) is 5-fluoro-2H-thiopyran.
What is the SMILES notation for 5-fluoro-2H-thiopyran?
The canonical SMILES for 5-fluoro-2H-thiopyran is FC1=CSCC=C1.
What is the InChIKey of 5-fluoro-2H-thiopyran?
The InChIKey is GVDJTHKYALPZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FS/c6-5-2-1-3-7-4-5/h1-2,4H,3H2.
What are the key properties of 5-fluoro-2H-thiopyran?
5-fluoro-2H-thiopyran has a molecular weight of 116.16 g/mol, XLogP of 2.10, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2H-thiopyran is sourced from PubChem (CID 123673076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).