4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one

C11H22N2O6 — CID 89011694

IUPAC4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one
SMILESCCOC(O)(O)CC1CN(COC)C(=O)N1COC
InChIInChI=1S/C11H22N2O6/c1-4-19-11(15,16)5-9-6-12(7-17-2)10(14)13(9)8-18-3/h9,15-16H,4-8H2,1-3H3
InChIKeyIXFSNQQSRMEGMF-UHFFFAOYSA-N
MW278.30 g/mol
LogP-0.63
Rot. Bonds8

About 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one

4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one (PubChem CID 89011694) has the molecular formula C11H22N2O6 and a molecular weight of 278.30 g/mol. Its IUPAC name is 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one
PubChem CID89011694
Molecular FormulaC11H22N2O6
Molecular Weight278.30 g/mol
Exact Mass278.15
IUPAC Name4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one
SMILESCCOC(O)(O)CC1CN(COC)C(=O)N1COC
InChIInChI=1S/C11H22N2O6/c1-4-19-11(15,16)5-9-6-12(7-17-2)10(14)13(9)8-18-3/h9,15-16H,4-8H2,1-3H3
InChIKeyIXFSNQQSRMEGMF-UHFFFAOYSA-N
XLogP-0.63
TPSA91.70 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one?
The IUPAC name of 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one (CID 89011694) is 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one.
What is the SMILES notation for 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one?
The canonical SMILES for 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one is CCOC(O)(O)CC1CN(COC)C(=O)N1COC.
What is the InChIKey of 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one?
The InChIKey is IXFSNQQSRMEGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O6/c1-4-19-11(15,16)5-9-6-12(7-17-2)10(14)13(9)8-18-3/h9,15-16H,4-8H2,1-3H3.
What are the key properties of 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one?
4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one has a molecular weight of 278.30 g/mol, XLogP of -0.63, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxy-2,2-dihydroxyethyl)-1,3-bis(methoxymethyl)imidazolidin-2-one is sourced from PubChem (CID 89011694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).