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

C8H11F3N2O2 — CID 15288962

IUPAC2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide
SMILESCC1(C(F)(F)F)CCC(=O)N1CC(N)=O
InChIInChI=1S/C8H11F3N2O2/c1-7(8(9,10)11)3-2-6(15)13(7)4-5(12)14/h2-4H2,1H3,(H2,12,14)
InChIKeyQISSOGWUVSAKNP-UHFFFAOYSA-N
MW224.18 g/mol
LogP0.42
Rot. Bonds2

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

2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide (PubChem CID 15288962) has the molecular formula C8H11F3N2O2 and a molecular weight of 224.18 g/mol. Its IUPAC name is 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide
PubChem CID15288962
Molecular FormulaC8H11F3N2O2
Molecular Weight224.18 g/mol
Exact Mass224.08
IUPAC Name2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide
SMILESCC1(C(F)(F)F)CCC(=O)N1CC(N)=O
InChIInChI=1S/C8H11F3N2O2/c1-7(8(9,10)11)3-2-6(15)13(7)4-5(12)14/h2-4H2,1H3,(H2,12,14)
InChIKeyQISSOGWUVSAKNP-UHFFFAOYSA-N
XLogP0.42
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.18
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide (CID 15288962) is 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide is CC1(C(F)(F)F)CCC(=O)N1CC(N)=O.
What is the InChIKey of 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
The InChIKey is QISSOGWUVSAKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N2O2/c1-7(8(9,10)11)3-2-6(15)13(7)4-5(12)14/h2-4H2,1H3,(H2,12,14).
What are the key properties of 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide?
2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide has a molecular weight of 224.18 g/mol, XLogP of 0.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-5-oxo-2-(trifluoromethyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 15288962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).