2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

C11H14F3N3O3 — CID 4880956

IUPAC2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC1(C2CC2)NC(=O)N(CC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C11H14F3N3O3/c1-10(6-2-3-6)8(19)17(9(20)16-10)4-7(18)15-5-11(12,13)14/h6H,2-5H2,1H3,(H,15,18)(H,16,20)
InChIKeyLAWPBFJBTNYSBM-UHFFFAOYSA-N
MW293.25 g/mol
LogP0.39
Rot. Bonds4

About 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 4880956) has the molecular formula C11H14F3N3O3 and a molecular weight of 293.25 g/mol. Its IUPAC name is 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID4880956
Molecular FormulaC11H14F3N3O3
Molecular Weight293.25 g/mol
Exact Mass293.10
IUPAC Name2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC1(C2CC2)NC(=O)N(CC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C11H14F3N3O3/c1-10(6-2-3-6)8(19)17(9(20)16-10)4-7(18)15-5-11(12,13)14/h6H,2-5H2,1H3,(H,15,18)(H,16,20)
InChIKeyLAWPBFJBTNYSBM-UHFFFAOYSA-N
XLogP0.39
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.25
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]cyclopropanecarboxamide
CID 4432972
N-[1-methyl-2,5-dioxo-4-(trifluoromethyl)-4-imidazolidinyl]pentanamide
CID 2968907
5,5-Dimethyl-3-[2-oxo-2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]imidazolidine-2,4-dione
CID 24982466
6-Methyl-2-propan-2-yl-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 46933611
2,2,6-Trimethyl-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 25198083
2,2-Dimethyl-6-propan-2-yl-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 25198084
6-Butyl-2,2-dimethyl-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 25198234
3-methyl-N-[1-(2-methylpropyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]butanamide
CID 45105963
5-Isobutyl-3-methylimidazolidine-2,4-dione
CID 271878
2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 3643364
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 4876726
2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 4877302

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 4880956) is 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is CC1(C2CC2)NC(=O)N(CC(=O)NCC(F)(F)F)C1=O.
What is the InChIKey of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is LAWPBFJBTNYSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O3/c1-10(6-2-3-6)8(19)17(9(20)16-10)4-7(18)15-5-11(12,13)14/h6H,2-5H2,1H3,(H,15,18)(H,16,20).
What are the key properties of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 293.25 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 4880956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).