ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate

C10H18N2O3 — CID 14618022

IUPACethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1C(=O)CNC1C(C)C
InChIInChI=1S/C10H18N2O3/c1-4-15-9(14)6-12-8(13)5-11-10(12)7(2)3/h7,10-11H,4-6H2,1-3H3
InChIKeyVLGCYTXRKGFZEM-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.04
Rot. Bonds4

About ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate

ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate (PubChem CID 14618022) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate
PubChem CID14618022
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Nameethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1C(=O)CNC1C(C)C
InChIInChI=1S/C10H18N2O3/c1-4-15-9(14)6-12-8(13)5-11-10(12)7(2)3/h7,10-11H,4-6H2,1-3H3
InChIKeyVLGCYTXRKGFZEM-UHFFFAOYSA-N
XLogP-0.04
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate?
The IUPAC name of ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate (CID 14618022) is ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate.
What is the SMILES notation for ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate?
The canonical SMILES for ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate is CCOC(=O)CN1C(=O)CNC1C(C)C.
What is the InChIKey of ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate?
The InChIKey is VLGCYTXRKGFZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-4-15-9(14)6-12-8(13)5-11-10(12)7(2)3/h7,10-11H,4-6H2,1-3H3.
What are the key properties of ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate?
ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate has a molecular weight of 214.26 g/mol, XLogP of -0.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(5-oxo-2-propan-2-ylimidazolidin-1-yl)acetate is sourced from PubChem (CID 14618022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).