methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate

C15H26N2O3 — CID 11594367

IUPACmethyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate
SMILESCOC(=O)C1=CON2C(C)(C)C(C)(C)NC12C(C)(C)C
InChIInChI=1S/C15H26N2O3/c1-12(2,3)15-10(11(18)19-8)9-20-17(15)14(6,7)13(4,5)16-15/h9,16H,1-8H3
InChIKeyYTLLRTKTGCVMAB-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.19
Rot. Bonds1

About methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate

methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate (PubChem CID 11594367) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate.

Molecular Properties

Compound Namemethyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate
PubChem CID11594367
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Namemethyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate
SMILESCOC(=O)C1=CON2C(C)(C)C(C)(C)NC12C(C)(C)C
InChIInChI=1S/C15H26N2O3/c1-12(2,3)15-10(11(18)19-8)9-20-17(15)14(6,7)13(4,5)16-15/h9,16H,1-8H3
InChIKeyYTLLRTKTGCVMAB-UHFFFAOYSA-N
XLogP2.19
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate with MolForge

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Related Compounds

methyl 2,2,3,3-tetramethyl-7a-(trifluoromethyl)-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate
CID 11558400
methyl 2,2,3,3,7a-pentamethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate
CID 11644394
Methyl 7a-tert-butyl-1,2,2,3,3-pentamethylimidazo[1,2-b][1,2]oxazole-7-carboxylate
CID 11493107

Frequently Asked Questions

What is the IUPAC name of methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate?
The IUPAC name of methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate (CID 11594367) is methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate.
What is the SMILES notation for methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate?
The canonical SMILES for methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate is COC(=O)C1=CON2C(C)(C)C(C)(C)NC12C(C)(C)C.
What is the InChIKey of methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate?
The InChIKey is YTLLRTKTGCVMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-12(2,3)15-10(11(18)19-8)9-20-17(15)14(6,7)13(4,5)16-15/h9,16H,1-8H3.
What are the key properties of methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate?
methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate has a molecular weight of 282.38 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7a-tert-butyl-2,2,3,3-tetramethyl-1H-imidazo[1,2-b][1,2]oxazole-7-carboxylate is sourced from PubChem (CID 11594367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).