3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one

C10H14FN3O3 — CID 121324760

IUPAC3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one
SMILESCN1CC(O)N(c2cc(C(C)(C)F)no2)C1=O
InChIInChI=1S/C10H14FN3O3/c1-10(2,11)6-4-8(17-12-6)14-7(15)5-13(3)9(14)16/h4,7,15H,5H2,1-3H3
InChIKeyPVLWGCVSCVQMIP-UHFFFAOYSA-N
MW243.24 g/mol
LogP1.07
Rot. Bonds2

About 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one

3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one (PubChem CID 121324760) has the molecular formula C10H14FN3O3 and a molecular weight of 243.24 g/mol. Its IUPAC name is 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one
PubChem CID121324760
Molecular FormulaC10H14FN3O3
Molecular Weight243.24 g/mol
Exact Mass243.10
IUPAC Name3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one
SMILESCN1CC(O)N(c2cc(C(C)(C)F)no2)C1=O
InChIInChI=1S/C10H14FN3O3/c1-10(2,11)6-4-8(17-12-6)14-7(15)5-13(3)9(14)16/h4,7,15H,5H2,1-3H3
InChIKeyPVLWGCVSCVQMIP-UHFFFAOYSA-N
XLogP1.07
TPSA69.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 51.07
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-methyl-1,3-diazinan-2-one
CID 155224865
4-hydroxy-1-methyl-3-[5-(1,1,1-trifluoro-2-methylpropan-2-yl)-1,2-oxazol-3-yl]imidazolidin-2-one
CID 121324759
5-ethyl-4-hydroxy-1-methyl-3-[3-(trifluoromethyl)-1,2-oxazol-5-yl]imidazolidin-2-one
CID 20560606
4-hydroxy-1-methyl-3-(5-propyl-1,2-oxazol-3-yl)imidazolidin-2-one
CID 70554763
3-[5-(2-fluoropropan-2-yl)-6-phenylpyridazin-3-yl]-4-hydroxy-1-methylimidazolidin-2-one
CID 118072339
3-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-4-hydroxy-1-methylimidazolidin-2-one
CID 118043352
1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxyimidazolidine-2,4-dione
CID 70491766
5-(5-hydroxy-3-methyl-2-oxoimidazolidin-1-yl)-3-methyl-1,2-oxazole-4-carbonitrile
CID 70554917
3-(5-tert-butyl-1,2-oxazol-3-yl)-4-methoxy-1-methylimidazolidin-2-one
CID 70493740
3-(5-tert-butyl-1,2-oxazol-3-yl)-4-chloro-1-methylimidazolidin-2-one
CID 20560592
ethane;N-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]propanamide
CID 170582956
4-hydroxy-1-methyl-3-[3-(2-phenylpropan-2-yl)-1,2-oxazol-5-yl]-5-prop-2-enylimidazolidin-2-one
CID 20560666

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one?
The IUPAC name of 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one (CID 121324760) is 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one.
What is the SMILES notation for 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one?
The canonical SMILES for 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one is CN1CC(O)N(c2cc(C(C)(C)F)no2)C1=O.
What is the InChIKey of 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one?
The InChIKey is PVLWGCVSCVQMIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O3/c1-10(2,11)6-4-8(17-12-6)14-7(15)5-13(3)9(14)16/h4,7,15H,5H2,1-3H3.
What are the key properties of 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one?
3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one has a molecular weight of 243.24 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-fluoropropan-2-yl)-1,2-oxazol-5-yl]-4-hydroxy-1-methylimidazolidin-2-one is sourced from PubChem (CID 121324760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).