5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one

C4H5F3N2O2 — CID 175829268

IUPAC5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one
SMILESO=C1NCC(O)N1C(F)(F)F
InChIInChI=1S/C4H5F3N2O2/c5-4(6,7)9-2(10)1-8-3(9)11/h2,10H,1H2,(H,8,11)
InChIKeyIBTPZRIYXIAKRU-UHFFFAOYSA-N
MW170.09 g/mol
LogP-0.15
Rot. Bonds

About 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one

5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one (PubChem CID 175829268) has the molecular formula C4H5F3N2O2 and a molecular weight of 170.09 g/mol. Its IUPAC name is 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one.

Molecular Properties

Compound Name5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one
PubChem CID175829268
Molecular FormulaC4H5F3N2O2
Molecular Weight170.09 g/mol
Exact Mass170.03
IUPAC Name5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one
SMILESO=C1NCC(O)N1C(F)(F)F
InChIInChI=1S/C4H5F3N2O2/c5-4(6,7)9-2(10)1-8-3(9)11/h2,10H,1H2,(H,8,11)
InChIKeyIBTPZRIYXIAKRU-UHFFFAOYSA-N
XLogP-0.15
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.09
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

Hydroxyethyl imidazolidinone
CID 77290
5-Hydroxy-1-methylimidazolidin-2-one
CID 13109371
4-Hydroxy-2-imidazolidinone
CID 20239908
N-(2-aminoethyl)-N'-(2-hydroxyethyl) imidazolidinone
CID 169449581
1-(2-(Trifluoromethoxy)ethyl)imidazolidin-2-one
CID 90427329
1-(2-Hydroxyethyl)-3-(trifluoromethyl)urea
CID 108865988
4-(Trifluoromethoxy)imidazolidin-2-one
CID 123243354
1-Methyl-5-(trifluoromethoxy)imidazolidin-2-one
CID 123288286
1-Methyl-4-(trifluoromethoxy)imidazolidin-2-one
CID 123405571
1-[2-(Difluoromethoxy)ethyl]imidazolidin-2-one
CID 177307004
4-(Hydroxymethyl)-5-(trifluoromethyl)imidazolidin-2-one
CID 84073160
1-(2-Hydroxyethyl)-3-(2,2,2-trifluoroethyl)imidazolidin-2-one
CID 84782199

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one?
The IUPAC name of 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one (CID 175829268) is 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one.
What is the SMILES notation for 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one?
The canonical SMILES for 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one is O=C1NCC(O)N1C(F)(F)F.
What is the InChIKey of 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one?
The InChIKey is IBTPZRIYXIAKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5F3N2O2/c5-4(6,7)9-2(10)1-8-3(9)11/h2,10H,1H2,(H,8,11).
What are the key properties of 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one?
5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one has a molecular weight of 170.09 g/mol, XLogP of -0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-(trifluoromethyl)imidazolidin-2-one is sourced from PubChem (CID 175829268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).