2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide

C5H7F3N2OS — CID 58880494

IUPAC2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide
SMILESO=C(NC1CNCS1)C(F)(F)F
InChIInChI=1S/C5H7F3N2OS/c6-5(7,8)4(11)10-3-1-9-2-12-3/h3,9H,1-2H2,(H,10,11)
InChIKeyXZXFCDAOZKPJJR-UHFFFAOYSA-N
MW200.18 g/mol
LogP0.28
Rot. Bonds1

About 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide

2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide (PubChem CID 58880494) has the molecular formula C5H7F3N2OS and a molecular weight of 200.18 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide
PubChem CID58880494
Molecular FormulaC5H7F3N2OS
Molecular Weight200.18 g/mol
Exact Mass200.02
IUPAC Name2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide
SMILESO=C(NC1CNCS1)C(F)(F)F
InChIInChI=1S/C5H7F3N2OS/c6-5(7,8)4(11)10-3-1-9-2-12-3/h3,9H,1-2H2,(H,10,11)
InChIKeyXZXFCDAOZKPJJR-UHFFFAOYSA-N
XLogP0.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.18
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide (CID 58880494) is 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide is O=C(NC1CNCS1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide?
The InChIKey is XZXFCDAOZKPJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F3N2OS/c6-5(7,8)4(11)10-3-1-9-2-12-3/h3,9H,1-2H2,(H,10,11).
What are the key properties of 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide?
2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide has a molecular weight of 200.18 g/mol, XLogP of 0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(1,3-thiazolidin-5-yl)acetamide is sourced from PubChem (CID 58880494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).