4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one

C8H8F3N3O3 — CID 14578123

IUPAC4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
SMILESCN1CC(O)N(c2cc(C(F)(F)F)no2)C1=O
InChIInChI=1S/C8H8F3N3O3/c1-13-3-5(15)14(7(13)16)6-2-4(12-17-6)8(9,10)11/h2,5,15H,3H2,1H3
InChIKeyCOUMCYMCSRHGLN-UHFFFAOYSA-N
MW251.16 g/mol
LogP0.88
Rot. Bonds1

About 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one

4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one (PubChem CID 14578123) has the molecular formula C8H8F3N3O3 and a molecular weight of 251.16 g/mol. Its IUPAC name is 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
PubChem CID14578123
Molecular FormulaC8H8F3N3O3
Molecular Weight251.16 g/mol
Exact Mass251.05
IUPAC Name4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
SMILESCN1CC(O)N(c2cc(C(F)(F)F)no2)C1=O
InChIInChI=1S/C8H8F3N3O3/c1-13-3-5(15)14(7(13)16)6-2-4(12-17-6)8(9,10)11/h2,5,15H,3H2,1H3
InChIKeyCOUMCYMCSRHGLN-UHFFFAOYSA-N
XLogP0.88
TPSA69.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-tert-Butyl-1,2-oxazol-5-yl)-4-hydroxy-1-methylimidazolidin-2-one
CID 156910
1-Butyl-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]urea
CID 14578078
4,5-Dihydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 14578139
4,5-Dihydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one;prop-1-en-2-olate
CID 20476511
4,5-Dihydroxy-1-prop-2-enyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20476539
4-Bromo-5-hydroxy-1-prop-2-enyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560561
1-Ethyl-4-hydroxy-5-prop-2-enyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560574
4-Bromo-1,5-bis(prop-2-enyl)-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560590
5-Ethyl-4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560606
4-Hydroxy-1-prop-2-enyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560677
4-Chloro-5-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560685
4-Hydroxy-1,5-bis(prop-2-enyl)-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560703

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one?
The IUPAC name of 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one (CID 14578123) is 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one?
The canonical SMILES for 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one is CN1CC(O)N(c2cc(C(F)(F)F)no2)C1=O.
What is the InChIKey of 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one?
The InChIKey is COUMCYMCSRHGLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N3O3/c1-13-3-5(15)14(7(13)16)6-2-4(12-17-6)8(9,10)11/h2,5,15H,3H2,1H3.
What are the key properties of 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one?
4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one has a molecular weight of 251.16 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one is sourced from PubChem (CID 14578123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).