1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one

C12H19N3O3 — CID 20560630

IUPAC1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one
SMILESCC1C(O)N(c2cc(C(C)(C)C)no2)C(=O)N1C
InChIInChI=1S/C12H19N3O3/c1-7-10(16)15(11(17)14(7)5)9-6-8(13-18-9)12(2,3)4/h6-7,10,16H,1-5H3
InChIKeyDNMMREBRDSPRJN-UHFFFAOYSA-N
MW253.30 g/mol
LogP1.55
Rot. Bonds1

About 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one

1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one (PubChem CID 20560630) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one.

Molecular Properties

Compound Name1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one
PubChem CID20560630
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one
SMILESCC1C(O)N(c2cc(C(C)(C)C)no2)C(=O)N1C
InChIInChI=1S/C12H19N3O3/c1-7-10(16)15(11(17)14(7)5)9-6-8(13-18-9)12(2,3)4/h6-7,10,16H,1-5H3
InChIKeyDNMMREBRDSPRJN-UHFFFAOYSA-N
XLogP1.55
TPSA69.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one?
The IUPAC name of 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one (CID 20560630) is 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one.
What is the SMILES notation for 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one?
The canonical SMILES for 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one is CC1C(O)N(c2cc(C(C)(C)C)no2)C(=O)N1C.
What is the InChIKey of 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one?
The InChIKey is DNMMREBRDSPRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-7-10(16)15(11(17)14(7)5)9-6-8(13-18-9)12(2,3)4/h6-7,10,16H,1-5H3.
What are the key properties of 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one?
1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one has a molecular weight of 253.30 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-tert-butyl-1,2-oxazol-5-yl)-5-hydroxy-3,4-dimethylimidazolidin-2-one is sourced from PubChem (CID 20560630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).