ethyl 2-(2-oxoimidazolidin-1-yl)acetate

C7H12N2O3 — CID 14678112

IUPACethyl 2-(2-oxoimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1CCNC1=O
InChIInChI=1S/C7H12N2O3/c1-2-12-6(10)5-9-4-3-8-7(9)11/h2-5H2,1H3,(H,8,11)
InChIKeyUYHLLRCIHJABRN-UHFFFAOYSA-N
MW172.18 g/mol
LogP-0.43
Rot. Bonds3

About ethyl 2-(2-oxoimidazolidin-1-yl)acetate

ethyl 2-(2-oxoimidazolidin-1-yl)acetate (PubChem CID 14678112) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is ethyl 2-(2-oxoimidazolidin-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-oxoimidazolidin-1-yl)acetate
PubChem CID14678112
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Nameethyl 2-(2-oxoimidazolidin-1-yl)acetate
SMILESCCOC(=O)CN1CCNC1=O
InChIInChI=1S/C7H12N2O3/c1-2-12-6(10)5-9-4-3-8-7(9)11/h2-5H2,1H3,(H,8,11)
InChIKeyUYHLLRCIHJABRN-UHFFFAOYSA-N
XLogP-0.43
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-oxoimidazolidin-1-yl)acetate?
The IUPAC name of ethyl 2-(2-oxoimidazolidin-1-yl)acetate (CID 14678112) is ethyl 2-(2-oxoimidazolidin-1-yl)acetate.
What is the SMILES notation for ethyl 2-(2-oxoimidazolidin-1-yl)acetate?
The canonical SMILES for ethyl 2-(2-oxoimidazolidin-1-yl)acetate is CCOC(=O)CN1CCNC1=O.
What is the InChIKey of ethyl 2-(2-oxoimidazolidin-1-yl)acetate?
The InChIKey is UYHLLRCIHJABRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c1-2-12-6(10)5-9-4-3-8-7(9)11/h2-5H2,1H3,(H,8,11).
What are the key properties of ethyl 2-(2-oxoimidazolidin-1-yl)acetate?
ethyl 2-(2-oxoimidazolidin-1-yl)acetate has a molecular weight of 172.18 g/mol, XLogP of -0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-oxoimidazolidin-1-yl)acetate is sourced from PubChem (CID 14678112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).