2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide

C7H9F3N2O2 — CID 15288966

IUPAC2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide
SMILESNC(=O)CN1C(=O)CCC1C(F)(F)F
InChIInChI=1S/C7H9F3N2O2/c8-7(9,10)4-1-2-6(14)12(4)3-5(11)13/h4H,1-3H2,(H2,11,13)
InChIKeyIRPSJIVGDHPXEV-UHFFFAOYSA-N
MW210.15 g/mol
LogP0.03
Rot. Bonds2

About 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide

2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide (PubChem CID 15288966) has the molecular formula C7H9F3N2O2 and a molecular weight of 210.15 g/mol. Its IUPAC name is 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide
PubChem CID15288966
Molecular FormulaC7H9F3N2O2
Molecular Weight210.15 g/mol
Exact Mass210.06
IUPAC Name2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide
SMILESNC(=O)CN1C(=O)CCC1C(F)(F)F
InChIInChI=1S/C7H9F3N2O2/c8-7(9,10)4-1-2-6(14)12(4)3-5(11)13/h4H,1-3H2,(H2,11,13)
InChIKeyIRPSJIVGDHPXEV-UHFFFAOYSA-N
XLogP0.03
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.15
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide (CID 15288966) is 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide is NC(=O)CN1C(=O)CCC1C(F)(F)F.
What is the InChIKey of 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The InChIKey is IRPSJIVGDHPXEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2O2/c8-7(9,10)4-1-2-6(14)12(4)3-5(11)13/h4H,1-3H2,(H2,11,13).
What are the key properties of 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide has a molecular weight of 210.15 g/mol, XLogP of 0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-5-(trifluoromethyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 15288966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).