N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide

C11H18F3N3O2 — CID 78957992

IUPACN-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(CN1CCCC1=O)NC(=O)CNCC(F)(F)F
InChIInChI=1S/C11H18F3N3O2/c1-8(6-17-4-2-3-10(17)19)16-9(18)5-15-7-11(12,13)14/h8,15H,2-7H2,1H3,(H,16,18)
InChIKeyWODJIHUCKFNMFM-UHFFFAOYSA-N
MW281.28 g/mol
LogP0.27
Rot. Bonds6

About N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78957992) has the molecular formula C11H18F3N3O2 and a molecular weight of 281.28 g/mol. Its IUPAC name is N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78957992
Molecular FormulaC11H18F3N3O2
Molecular Weight281.28 g/mol
Exact Mass281.14
IUPAC NameN-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(CN1CCCC1=O)NC(=O)CNCC(F)(F)F
InChIInChI=1S/C11H18F3N3O2/c1-8(6-17-4-2-3-10(17)19)16-9(18)5-15-7-11(12,13)14/h8,15H,2-7H2,1H3,(H,16,18)
InChIKeyWODJIHUCKFNMFM-UHFFFAOYSA-N
XLogP0.27
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
CID 54863219
2-amino-N-[2-oxo-2-[1-(2-oxopyrrolidin-1-yl)propan-2-ylamino]ethyl]acetamide
CID 54863279
N-(1-piperidin-1-ylpropan-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958032
N-(1-morpholin-4-ylpropan-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924254
N-[(2R)-1-hydroxypropan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 107218513
2-(3-amino-1,2,4-triazol-1-yl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
CID 61102795
tert-butyl N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]carbamate
CID 63789574
1-[2-(6,6,6-trifluorohexan-2-ylamino)propyl]pyrrolidin-2-one
CID 116534604
2-(4-aminopiperidin-1-yl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
CID 79328385
1-[2-[(3-hydroxy-2,2-dimethylpropyl)amino]propyl]pyrrolidin-2-one
CID 81411750
1-cyclobutyl-3-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]urea
CID 136524316
phenyl N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]carbamate
CID 61069095

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 78957992) is N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide is CC(CN1CCCC1=O)NC(=O)CNCC(F)(F)F.
What is the InChIKey of N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is WODJIHUCKFNMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3N3O2/c1-8(6-17-4-2-3-10(17)19)16-9(18)5-15-7-11(12,13)14/h8,15H,2-7H2,1H3,(H,16,18).
What are the key properties of N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 281.28 g/mol, XLogP of 0.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78957992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).