2-(difluoromethyl)-2-methyl-1,3-thiazolidine

C5H9F2NS — CID 11789409

IUPAC2-(difluoromethyl)-2-methyl-1,3-thiazolidine
SMILESCC1(C(F)F)NCCS1
InChIInChI=1S/C5H9F2NS/c1-5(4(6)7)8-2-3-9-5/h4,8H,2-3H2,1H3
InChIKeyIYVNEKNHOOZMBI-UHFFFAOYSA-N
MW153.20 g/mol
LogP1.30
Rot. Bonds1

About 2-(difluoromethyl)-2-methyl-1,3-thiazolidine

2-(difluoromethyl)-2-methyl-1,3-thiazolidine (PubChem CID 11789409) has the molecular formula C5H9F2NS and a molecular weight of 153.20 g/mol. Its IUPAC name is 2-(difluoromethyl)-2-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(difluoromethyl)-2-methyl-1,3-thiazolidine
PubChem CID11789409
Molecular FormulaC5H9F2NS
Molecular Weight153.20 g/mol
Exact Mass153.04
IUPAC Name2-(difluoromethyl)-2-methyl-1,3-thiazolidine
SMILESCC1(C(F)F)NCCS1
InChIInChI=1S/C5H9F2NS/c1-5(4(6)7)8-2-3-9-5/h4,8H,2-3H2,1H3
InChIKeyIYVNEKNHOOZMBI-UHFFFAOYSA-N
XLogP1.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.20
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-2-methyl-1,3-thiazolidine?
The IUPAC name of 2-(difluoromethyl)-2-methyl-1,3-thiazolidine (CID 11789409) is 2-(difluoromethyl)-2-methyl-1,3-thiazolidine.
What is the SMILES notation for 2-(difluoromethyl)-2-methyl-1,3-thiazolidine?
The canonical SMILES for 2-(difluoromethyl)-2-methyl-1,3-thiazolidine is CC1(C(F)F)NCCS1.
What is the InChIKey of 2-(difluoromethyl)-2-methyl-1,3-thiazolidine?
The InChIKey is IYVNEKNHOOZMBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NS/c1-5(4(6)7)8-2-3-9-5/h4,8H,2-3H2,1H3.
What are the key properties of 2-(difluoromethyl)-2-methyl-1,3-thiazolidine?
2-(difluoromethyl)-2-methyl-1,3-thiazolidine has a molecular weight of 153.20 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-2-methyl-1,3-thiazolidine is sourced from PubChem (CID 11789409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).