1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one

C7H11F3N2O2 — CID 20511509

IUPAC1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
SMILESCOCCN1CC(C(F)(F)F)NC1=O
InChIInChI=1S/C7H11F3N2O2/c1-14-3-2-12-4-5(7(8,9)10)11-6(12)13/h5H,2-4H2,1H3,(H,11,13)
InChIKeySVZJKFKRECEBFG-UHFFFAOYSA-N
MW212.17 g/mol
LogP0.59
Rot. Bonds3

About 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one

1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one (PubChem CID 20511509) has the molecular formula C7H11F3N2O2 and a molecular weight of 212.17 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
PubChem CID20511509
Molecular FormulaC7H11F3N2O2
Molecular Weight212.17 g/mol
Exact Mass212.08
IUPAC Name1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
SMILESCOCCN1CC(C(F)(F)F)NC1=O
InChIInChI=1S/C7H11F3N2O2/c1-14-3-2-12-4-5(7(8,9)10)11-6(12)13/h5H,2-4H2,1H3,(H,11,13)
InChIKeySVZJKFKRECEBFG-UHFFFAOYSA-N
XLogP0.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one (CID 20511509) is 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one is COCCN1CC(C(F)(F)F)NC1=O.
What is the InChIKey of 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one?
The InChIKey is SVZJKFKRECEBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3N2O2/c1-14-3-2-12-4-5(7(8,9)10)11-6(12)13/h5H,2-4H2,1H3,(H,11,13).
What are the key properties of 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one?
1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one has a molecular weight of 212.17 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one is sourced from PubChem (CID 20511509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).