2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

C10H14F3N3O3 — CID 17392685

IUPAC2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCCC1NC(=O)N(CC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C10H14F3N3O3/c1-2-3-6-8(18)16(9(19)15-6)4-7(17)14-5-10(11,12)13/h6H,2-5H2,1H3,(H,14,17)(H,15,19)
InChIKeyQNSOUMFFGMDQMM-UHFFFAOYSA-N
MW281.23 g/mol
LogP0.39
Rot. Bonds5

About 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide

2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 17392685) has the molecular formula C10H14F3N3O3 and a molecular weight of 281.23 g/mol. Its IUPAC name is 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID17392685
Molecular FormulaC10H14F3N3O3
Molecular Weight281.23 g/mol
Exact Mass281.10
IUPAC Name2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCCC1NC(=O)N(CC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C10H14F3N3O3/c1-2-3-6-8(18)16(9(19)15-6)4-7(17)14-5-10(11,12)13/h6H,2-5H2,1H3,(H,14,17)(H,15,19)
InChIKeyQNSOUMFFGMDQMM-UHFFFAOYSA-N
XLogP0.39
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.23
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

CID 3692535
CID 3692535
CID 2968525
CID 2968525
CID 2968907
CID 2968907
CID 567619
CID 567619
CID 3238722
CID 3238722
CID 13239554
CID 13239554
CID 2969317
CID 2969317
CID 45105963
CID 45105963
CID 72141067
CID 72141067
CID 271878
CID 271878
CID 335477
CID 335477
CID 19702728
CID 19702728

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 17392685) is 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is CCCC1NC(=O)N(CC(=O)NCC(F)(F)F)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is QNSOUMFFGMDQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O3/c1-2-3-6-8(18)16(9(19)15-6)4-7(17)14-5-10(11,12)13/h6H,2-5H2,1H3,(H,14,17)(H,15,19).
What are the key properties of 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 281.23 g/mol, XLogP of 0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 17392685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).