3-(2-fluoroethyl)-1,3-thiazol-2-one

C5H6FNOS — CID 115749769

IUPAC3-(2-fluoroethyl)-1,3-thiazol-2-one
SMILESO=c1sccn1CCF
InChIInChI=1S/C5H6FNOS/c6-1-2-7-3-4-9-5(7)8/h3-4H,1-2H2
InChIKeyIIXHZSOIBMFUOO-UHFFFAOYSA-N
MW147.17 g/mol
LogP0.88
Rot. Bonds2

About 3-(2-fluoroethyl)-1,3-thiazol-2-one

3-(2-fluoroethyl)-1,3-thiazol-2-one (PubChem CID 115749769) has the molecular formula C5H6FNOS and a molecular weight of 147.17 g/mol. Its IUPAC name is 3-(2-fluoroethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name3-(2-fluoroethyl)-1,3-thiazol-2-one
PubChem CID115749769
Molecular FormulaC5H6FNOS
Molecular Weight147.17 g/mol
Exact Mass147.02
IUPAC Name3-(2-fluoroethyl)-1,3-thiazol-2-one
SMILESO=c1sccn1CCF
InChIInChI=1S/C5H6FNOS/c6-1-2-7-3-4-9-5(7)8/h3-4H,1-2H2
InChIKeyIIXHZSOIBMFUOO-UHFFFAOYSA-N
XLogP0.88
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Prop-2-yn-1-yl)-2,3-dihydro-1,3-thiazol-2-one
CID 54129749
3-methyl-3H-thiazol-2-one
CID 12743050
3-Ethenyl-1,3-thiazolidin-2-one
CID 14094555
3-(Difluoromethyl)-1,3-thiazol-2-one
CID 15171125
3-(Trifluoromethyl)-1,3-thiazol-2-one
CID 49781570
Trifluoro-[(2-oxo-1,3-thiazol-3-yl)methyl]boranuide
CID 63703627
3-(2,2,2-Trifluoroethyl)-1,3-thiazol-2-one
CID 115659231
3-(3,3,3-Trifluoropropyl)-1,3-thiazol-2-one
CID 115672986
3-(3-Fluoropropyl)-1,3-thiazol-2-one
CID 115706050
3-(2,2-Difluoroethyl)-1,3-thiazol-2-one
CID 115749768
3-(4,4,4-Trifluorobutyl)-1,3-thiazol-2-one
CID 116622657
3-[2-(Trifluoromethylsulfanyl)ethyl]-1,3-thiazol-2-one
CID 116622658

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethyl)-1,3-thiazol-2-one?
The IUPAC name of 3-(2-fluoroethyl)-1,3-thiazol-2-one (CID 115749769) is 3-(2-fluoroethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 3-(2-fluoroethyl)-1,3-thiazol-2-one?
The canonical SMILES for 3-(2-fluoroethyl)-1,3-thiazol-2-one is O=c1sccn1CCF.
What is the InChIKey of 3-(2-fluoroethyl)-1,3-thiazol-2-one?
The InChIKey is IIXHZSOIBMFUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FNOS/c6-1-2-7-3-4-9-5(7)8/h3-4H,1-2H2.
What are the key properties of 3-(2-fluoroethyl)-1,3-thiazol-2-one?
3-(2-fluoroethyl)-1,3-thiazol-2-one has a molecular weight of 147.17 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 115749769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).