ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate

C10H18N4O4 — CID 67258355

IUPACethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate
SMILESCCOC(=O)CNC(=O)NCCN1CCNC1=O
InChIInChI=1S/C10H18N4O4/c1-2-18-8(15)7-13-9(16)11-3-5-14-6-4-12-10(14)17/h2-7H2,1H3,(H,12,17)(H2,11,13,16)
InChIKeyULCDXCJOSGJQSB-UHFFFAOYSA-N
MW258.28 g/mol
LogP-1.13
Rot. Bonds6

About ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate

ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate (PubChem CID 67258355) has the molecular formula C10H18N4O4 and a molecular weight of 258.28 g/mol. Its IUPAC name is ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate.

Molecular Properties

Compound Nameethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate
PubChem CID67258355
Molecular FormulaC10H18N4O4
Molecular Weight258.28 g/mol
Exact Mass258.13
IUPAC Nameethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate
SMILESCCOC(=O)CNC(=O)NCCN1CCNC1=O
InChIInChI=1S/C10H18N4O4/c1-2-18-8(15)7-13-9(16)11-3-5-14-6-4-12-10(14)17/h2-7H2,1H3,(H,12,17)(H2,11,13,16)
InChIKeyULCDXCJOSGJQSB-UHFFFAOYSA-N
XLogP-1.13
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate?
The IUPAC name of ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate (CID 67258355) is ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate.
What is the SMILES notation for ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate?
The canonical SMILES for ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate is CCOC(=O)CNC(=O)NCCN1CCNC1=O.
What is the InChIKey of ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate?
The InChIKey is ULCDXCJOSGJQSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O4/c1-2-18-8(15)7-13-9(16)11-3-5-14-6-4-12-10(14)17/h2-7H2,1H3,(H,12,17)(H2,11,13,16).
What are the key properties of ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate?
ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate has a molecular weight of 258.28 g/mol, XLogP of -1.13, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylamino]acetate is sourced from PubChem (CID 67258355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).