1,3-bis(ethoxymethyl)imidazolidin-2-one

C18H36N4O6 — CID 159426248

IUPAC1,3-bis(ethoxymethyl)imidazolidin-2-one
SMILESCCOCN1CCN(COCC)C1=O.CCOCN1CCN(COCC)C1=O
InChIInChI=1S/2C9H18N2O3/c2*1-3-13-7-10-5-6-11(9(10)12)8-14-4-2/h2*3-8H2,1-2H3
InChIKeyLQJVKVCMKJRQGE-UHFFFAOYSA-N
MW404.51 g/mol
LogP1.42
Rot. Bonds12

About 1,3-bis(ethoxymethyl)imidazolidin-2-one

1,3-bis(ethoxymethyl)imidazolidin-2-one (PubChem CID 159426248) has the molecular formula C18H36N4O6 and a molecular weight of 404.51 g/mol. Its IUPAC name is 1,3-bis(ethoxymethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1,3-bis(ethoxymethyl)imidazolidin-2-one
PubChem CID159426248
Molecular FormulaC18H36N4O6
Molecular Weight404.51 g/mol
Exact Mass404.26
IUPAC Name1,3-bis(ethoxymethyl)imidazolidin-2-one
SMILESCCOCN1CCN(COCC)C1=O.CCOCN1CCN(COCC)C1=O
InChIInChI=1S/2C9H18N2O3/c2*1-3-13-7-10-5-6-11(9(10)12)8-14-4-2/h2*3-8H2,1-2H3
InChIKeyLQJVKVCMKJRQGE-UHFFFAOYSA-N
XLogP1.42
TPSA84.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-cyclobutyl-3-(ethoxymethyl)imidazolidin-2-one
CID 166943016
1,3-bis(2-methylpropoxymethyl)imidazolidin-2-one
CID 158416562
1,3-bis(methoxymethyl)imidazolidin-2-one
CID 161294962
1,3-bis(2-propoxyethyl)imidazolidin-2-one
CID 139925751
1,3,4,6-tetrakis(ethoxymethyl)-3a,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione
CID 22182311
1-(2-hydroxyethyl)-3-(methoxymethyl)imidazolidin-2-one
CID 67989939
1,3-dibutylimidazolidin-2-one
CID 20887
1-hydroxy-3-(methoxymethyl)imidazolidin-2-one
CID 45082831
1-(2-ethoxyethyl)piperidin-4-one
CID 15410842
1,3-dioctylimidazolidin-2-one
CID 19987667
1-(3-ethoxy-2-hydroxypropyl)piperidin-4-one
CID 63931756
1,3-bis(ethoxymethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 118434025

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(ethoxymethyl)imidazolidin-2-one?
The IUPAC name of 1,3-bis(ethoxymethyl)imidazolidin-2-one (CID 159426248) is 1,3-bis(ethoxymethyl)imidazolidin-2-one.
What is the SMILES notation for 1,3-bis(ethoxymethyl)imidazolidin-2-one?
The canonical SMILES for 1,3-bis(ethoxymethyl)imidazolidin-2-one is CCOCN1CCN(COCC)C1=O.CCOCN1CCN(COCC)C1=O.
What is the InChIKey of 1,3-bis(ethoxymethyl)imidazolidin-2-one?
The InChIKey is LQJVKVCMKJRQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H18N2O3/c2*1-3-13-7-10-5-6-11(9(10)12)8-14-4-2/h2*3-8H2,1-2H3.
What are the key properties of 1,3-bis(ethoxymethyl)imidazolidin-2-one?
1,3-bis(ethoxymethyl)imidazolidin-2-one has a molecular weight of 404.51 g/mol, XLogP of 1.42, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(ethoxymethyl)imidazolidin-2-one is sourced from PubChem (CID 159426248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).