1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one

C11H19F3N2O3 — CID 139925654

IUPAC1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one
SMILESCOCCN1CCN(C(COC)CC(F)(F)F)C1=O
InChIInChI=1S/C11H19F3N2O3/c1-18-6-5-15-3-4-16(10(15)17)9(8-19-2)7-11(12,13)14/h9H,3-8H2,1-2H3
InChIKeyQIBLIWLBPIYINE-UHFFFAOYSA-N
MW284.28 g/mol
LogP1.34
Rot. Bonds7

About 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one

1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one (PubChem CID 139925654) has the molecular formula C11H19F3N2O3 and a molecular weight of 284.28 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one
PubChem CID139925654
Molecular FormulaC11H19F3N2O3
Molecular Weight284.28 g/mol
Exact Mass284.13
IUPAC Name1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one
SMILESCOCCN1CCN(C(COC)CC(F)(F)F)C1=O
InChIInChI=1S/C11H19F3N2O3/c1-18-6-5-15-3-4-16(10(15)17)9(8-19-2)7-11(12,13)14/h9H,3-8H2,1-2H3
InChIKeyQIBLIWLBPIYINE-UHFFFAOYSA-N
XLogP1.34
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.28
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
CID 20511509
3-Cyclopropyl-1-ethyl-4-(2,2,2-trifluoroethoxy)imidazolidin-2-one
CID 60000029
1,3-Bis(1-fluoro-2-methoxyethyl)-4,5-dipropylimidazolidin-2-one
CID 139925592
1-(4-Fluoro-1-methoxy-3-methylbutan-2-yl)-3-(2-methoxyethyl)imidazolidin-2-one
CID 139925596
1-(2-Ethyl-2-methoxybutyl)-3-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
CID 139925602
4,4,5-Trifluoro-1,3-bis(2-methoxyethyl)imidazolidin-2-one
CID 139925607
1,3-Bis[2-(fluoromethoxy)ethyl]imidazolidin-2-one
CID 139925611
4,5-Difluoro-1,3-bis(2-methoxybutyl)imidazolidin-2-one
CID 139925623
1-(1-Fluoro-3-methoxy-2-methylpropan-2-yl)-3-(2-methoxyethyl)-4-methylimidazolidin-2-one
CID 139925626
4-Iodo-1,3-bis(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one
CID 139925637
4-Fluoro-3-(2-methoxyethyl)-1-(1-methoxypropan-2-yl)imidazolidin-2-one
CID 139925648
1-(2-Methoxyethyl)-3-[1,1,1-trifluoro-3-(trifluoromethoxy)butan-2-yl]imidazolidin-2-one
CID 139925658

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one (CID 139925654) is 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one is COCCN1CCN(C(COC)CC(F)(F)F)C1=O.
What is the InChIKey of 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one?
The InChIKey is QIBLIWLBPIYINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O3/c1-18-6-5-15-3-4-16(10(15)17)9(8-19-2)7-11(12,13)14/h9H,3-8H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one?
1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one has a molecular weight of 284.28 g/mol, XLogP of 1.34, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-3-(4,4,4-trifluoro-1-methoxybutan-2-yl)imidazolidin-2-one is sourced from PubChem (CID 139925654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).