1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol

C6H11F3N2O — CID 170719763

IUPAC1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol
SMILESCN1CCN(CC(F)(F)F)C1O
InChIInChI=1S/C6H11F3N2O/c1-10-2-3-11(5(10)12)4-6(7,8)9/h5,12H,2-4H2,1H3
InChIKeyLWKLIHPKFXNLPP-UHFFFAOYSA-N
MW184.16 g/mol
LogP0.07
Rot. Bonds1

About 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol

1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol (PubChem CID 170719763) has the molecular formula C6H11F3N2O and a molecular weight of 184.16 g/mol. Its IUPAC name is 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol.

Molecular Properties

Compound Name1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol
PubChem CID170719763
Molecular FormulaC6H11F3N2O
Molecular Weight184.16 g/mol
Exact Mass184.08
IUPAC Name1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol
SMILESCN1CCN(CC(F)(F)F)C1O
InChIInChI=1S/C6H11F3N2O/c1-10-2-3-11(5(10)12)4-6(7,8)9/h5,12H,2-4H2,1H3
InChIKeyLWKLIHPKFXNLPP-UHFFFAOYSA-N
XLogP0.07
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 118103383
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[3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]methanol
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6-(2,2,2-trifluoroethyl)-6-azabicyclo[3.2.1]octan-2-ol
CID 117050719
4-methyl-1-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 126789756
(2R,3S)-2,3-dimethyl-1-(2,2,2-trifluoroethyl)piperidine
CID 152872015
1-methyl-4-(2,2,2-trifluoroethyl)piperazine
CID 23236212
2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]cyclohexan-1-ol
CID 114339767
[(3R)-3-methyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl] 2,2-dimethylpropanoate
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2-(2,3-dimethylimidazolidin-1-yl)ethanol
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol?
The IUPAC name of 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol (CID 170719763) is 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol.
What is the SMILES notation for 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol?
The canonical SMILES for 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol is CN1CCN(CC(F)(F)F)C1O.
What is the InChIKey of 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol?
The InChIKey is LWKLIHPKFXNLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2O/c1-10-2-3-11(5(10)12)4-6(7,8)9/h5,12H,2-4H2,1H3.
What are the key properties of 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol?
1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol has a molecular weight of 184.16 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2,2,2-trifluoroethyl)imidazolidin-2-ol is sourced from PubChem (CID 170719763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).