ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate

C11H20N2O3 — CID 134894331

IUPACethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1C(=O)CNC1C(C)(C)C
InChIInChI=1S/C11H20N2O3/c1-5-16-9(15)7-13-8(14)6-12-10(13)11(2,3)4/h10,12H,5-7H2,1-4H3
InChIKeyDRGRUBGYSNVLRO-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.35
Rot. Bonds3

About ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate

ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate (PubChem CID 134894331) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate
PubChem CID134894331
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Nameethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1C(=O)CNC1C(C)(C)C
InChIInChI=1S/C11H20N2O3/c1-5-16-9(15)7-13-8(14)6-12-10(13)11(2,3)4/h10,12H,5-7H2,1-4H3
InChIKeyDRGRUBGYSNVLRO-UHFFFAOYSA-N
XLogP0.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 2-(2,5-dioxoimidazolidin-1-yl)acetate
CID 2512407
Ethyl (4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)acetate
CID 14678127
Ethyl 2-(3-carbamoyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 155490233
Ethyl 2-({[3-(2-amino-2-oxoethyl)-2,4-dioxoimidazolidin-1-yl]carbonyl}amino)acetate
CID 155490328
Ethyl 2-{3-[(2-amino-2-oxoethyl)carbamoyl]-2,5-dioxoimidazolidin-1-yl}acetate
CID 155490329
Ethyl 2-[[2-(methylcarbamoylamino)-2-oxoethyl]-(2-methylpropyl)amino]acetate
CID 47454097
1-(2-Acetoxyethyl)-4,4-dimethyl-2,5-dioxoimidazolidine
CID 593013
Ethyl 2-(2,4,5-trioxoimidazolidin-1-yl)acetate
CID 2736482
Ethyl 2-isopropyl-5-oxo-1-imidazolidineacetate
CID 14618022
Ethyl 2-(2-oxoimidazolidin-1-yl)acetate
CID 14678112
Ethyl 2-(3-butyl-2,4,5-trioxoimidazolidin-1-yl)acetate
CID 15096136
Ethyl 2-[3-(2-methylpropyl)-2,4,5-trioxoimidazolidin-1-yl]acetate
CID 15096137

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate?
The IUPAC name of ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate (CID 134894331) is ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate.
What is the SMILES notation for ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate?
The canonical SMILES for ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate is CCOC(=O)CN1C(=O)CNC1C(C)(C)C.
What is the InChIKey of ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate?
The InChIKey is DRGRUBGYSNVLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-5-16-9(15)7-13-8(14)6-12-10(13)11(2,3)4/h10,12H,5-7H2,1-4H3.
What are the key properties of ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate?
ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate has a molecular weight of 228.29 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-tert-butyl-5-oxoimidazolidin-1-yl)acetate is sourced from PubChem (CID 134894331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).