[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate

C11H18N2O5 — CID 759712

IUPAC[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate
SMILESCCN1C(=O)N(CC)[C@H](OC(C)=O)[C@H]1OC(C)=O
InChIInChI=1S/C11H18N2O5/c1-5-12-9(17-7(3)14)10(18-8(4)15)13(6-2)11(12)16/h9-10H,5-6H2,1-4H3/t9-,10-/m1/s1
InChIKeyCMBOMSKDSWNIAR-NXEZZACHSA-N
MW258.27 g/mol
LogP0.54
Rot. Bonds4

About [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate

[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate (PubChem CID 759712) has the molecular formula C11H18N2O5 and a molecular weight of 258.27 g/mol. Its IUPAC name is [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate.

Molecular Properties

Compound Name[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate
PubChem CID759712
Molecular FormulaC11H18N2O5
Molecular Weight258.27 g/mol
Exact Mass258.12
IUPAC Name[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate
SMILESCCN1C(=O)N(CC)[C@H](OC(C)=O)[C@H]1OC(C)=O
InChIInChI=1S/C11H18N2O5/c1-5-12-9(17-7(3)14)10(18-8(4)15)13(6-2)11(12)16/h9-10H,5-6H2,1-4H3/t9-,10-/m1/s1
InChIKeyCMBOMSKDSWNIAR-NXEZZACHSA-N
XLogP0.54
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate?
The IUPAC name of [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate (CID 759712) is [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate.
What is the SMILES notation for [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate?
The canonical SMILES for [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate is CCN1C(=O)N(CC)[C@H](OC(C)=O)[C@H]1OC(C)=O.
What is the InChIKey of [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate?
The InChIKey is CMBOMSKDSWNIAR-NXEZZACHSA-N. The full InChI is InChI=1S/C11H18N2O5/c1-5-12-9(17-7(3)14)10(18-8(4)15)13(6-2)11(12)16/h9-10H,5-6H2,1-4H3/t9-,10-/m1/s1.
What are the key properties of [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate?
[(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate has a molecular weight of 258.27 g/mol, XLogP of 0.54, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R,5R)-5-acetyloxy-1,3-diethyl-2-oxoimidazolidin-4-yl] acetate is sourced from PubChem (CID 759712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).