2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide

C6H7F3N2O2 — CID 10535860

IUPAC2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide
SMILESO=C1NCCC1NC(=O)C(F)(F)F
InChIInChI=1S/C6H7F3N2O2/c7-6(8,9)5(13)11-3-1-2-10-4(3)12/h3H,1-2H2,(H,10,12)(H,11,13)
InChIKeyORQZPZWDDRVGNI-UHFFFAOYSA-N
MW196.13 g/mol
LogP-0.45
Rot. Bonds1

About 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide

2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide (PubChem CID 10535860) has the molecular formula C6H7F3N2O2 and a molecular weight of 196.13 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide
PubChem CID10535860
Molecular FormulaC6H7F3N2O2
Molecular Weight196.13 g/mol
Exact Mass196.05
IUPAC Name2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide
SMILESO=C1NCCC1NC(=O)C(F)(F)F
InChIInChI=1S/C6H7F3N2O2/c7-6(8,9)5(13)11-3-1-2-10-4(3)12/h3H,1-2H2,(H,10,12)(H,11,13)
InChIKeyORQZPZWDDRVGNI-UHFFFAOYSA-N
XLogP-0.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.13
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide (CID 10535860) is 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide is O=C1NCCC1NC(=O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide?
The InChIKey is ORQZPZWDDRVGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3N2O2/c7-6(8,9)5(13)11-3-1-2-10-4(3)12/h3H,1-2H2,(H,10,12)(H,11,13).
What are the key properties of 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide?
2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide has a molecular weight of 196.13 g/mol, XLogP of -0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-oxopyrrolidin-3-yl)acetamide is sourced from PubChem (CID 10535860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).