2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine

C11H13F2NS — CID 66229355

IUPAC2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine
SMILESCCC1CSC(c2cc(F)ccc2F)N1
InChIInChI=1S/C11H13F2NS/c1-2-8-6-15-11(14-8)9-5-7(12)3-4-10(9)13/h3-5,8,11,14H,2,6H2,1H3
InChIKeyYMFVUSRYMKZECJ-UHFFFAOYSA-N
MW229.29 g/mol
LogP3.08
Rot. Bonds2

About 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine

2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine (PubChem CID 66229355) has the molecular formula C11H13F2NS and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine
PubChem CID66229355
Molecular FormulaC11H13F2NS
Molecular Weight229.29 g/mol
Exact Mass229.07
IUPAC Name2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine
SMILESCCC1CSC(c2cc(F)ccc2F)N1
InChIInChI=1S/C11H13F2NS/c1-2-8-6-15-11(14-8)9-5-7(12)3-4-10(9)13/h3-5,8,11,14H,2,6H2,1H3
InChIKeyYMFVUSRYMKZECJ-UHFFFAOYSA-N
XLogP3.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine?
The IUPAC name of 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine (CID 66229355) is 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine.
What is the SMILES notation for 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine?
The canonical SMILES for 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine is CCC1CSC(c2cc(F)ccc2F)N1.
What is the InChIKey of 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine?
The InChIKey is YMFVUSRYMKZECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NS/c1-2-8-6-15-11(14-8)9-5-7(12)3-4-10(9)13/h3-5,8,11,14H,2,6H2,1H3.
What are the key properties of 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine?
2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine has a molecular weight of 229.29 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-4-ethyl-1,3-thiazolidine is sourced from PubChem (CID 66229355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).