1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one

C10H18N2O3 — CID 80582047

IUPAC1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one
SMILESCC(C)n1ccn(CCOCCO)c1=O
InChIInChI=1S/C10H18N2O3/c1-9(2)12-4-3-11(10(12)14)5-7-15-8-6-13/h3-4,9,13H,5-8H2,1-2H3
InChIKeyDHOZDDYBRZGYOG-UHFFFAOYSA-N
MW214.26 g/mol
LogP0.24
Rot. Bonds6

About 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one

1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one (PubChem CID 80582047) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one.

Molecular Properties

Compound Name1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one
PubChem CID80582047
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one
SMILESCC(C)n1ccn(CCOCCO)c1=O
InChIInChI=1S/C10H18N2O3/c1-9(2)12-4-3-11(10(12)14)5-7-15-8-6-13/h3-4,9,13H,5-8H2,1-2H3
InChIKeyDHOZDDYBRZGYOG-UHFFFAOYSA-N
XLogP0.24
TPSA56.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one?
The IUPAC name of 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one (CID 80582047) is 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one.
What is the SMILES notation for 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one?
The canonical SMILES for 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one is CC(C)n1ccn(CCOCCO)c1=O.
What is the InChIKey of 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one?
The InChIKey is DHOZDDYBRZGYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-9(2)12-4-3-11(10(12)14)5-7-15-8-6-13/h3-4,9,13H,5-8H2,1-2H3.
What are the key properties of 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one?
1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one has a molecular weight of 214.26 g/mol, XLogP of 0.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxyethoxy)ethyl]-3-propan-2-ylimidazol-2-one is sourced from PubChem (CID 80582047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).