2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol

C11H22N2O4 — CID 69232482

IUPAC2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol
SMILESOCCOCCN1C=CN(CCOCCO)C1
InChIInChI=1S/C11H22N2O4/c14-5-9-16-7-3-12-1-2-13(11-12)4-8-17-10-6-15/h1-2,14-15H,3-11H2
InChIKeyZGCKKASJPPKQLY-UHFFFAOYSA-N
MW246.31 g/mol
LogP-0.95
Rot. Bonds10

About 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol

2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol (PubChem CID 69232482) has the molecular formula C11H22N2O4 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol
PubChem CID69232482
Molecular FormulaC11H22N2O4
Molecular Weight246.31 g/mol
Exact Mass246.16
IUPAC Name2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol
SMILESOCCOCCN1C=CN(CCOCCO)C1
InChIInChI=1S/C11H22N2O4/c14-5-9-16-7-3-12-1-2-13(11-12)4-8-17-10-6-15/h1-2,14-15H,3-11H2
InChIKeyZGCKKASJPPKQLY-UHFFFAOYSA-N
XLogP-0.95
TPSA65.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol?
The IUPAC name of 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol (CID 69232482) is 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol?
The canonical SMILES for 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol is OCCOCCN1C=CN(CCOCCO)C1.
What is the InChIKey of 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol?
The InChIKey is ZGCKKASJPPKQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4/c14-5-9-16-7-3-12-1-2-13(11-12)4-8-17-10-6-15/h1-2,14-15H,3-11H2.
What are the key properties of 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol?
2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol has a molecular weight of 246.31 g/mol, XLogP of -0.95, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-[2-(2-hydroxyethoxy)ethyl]-2H-imidazol-1-yl]ethoxy]ethanol is sourced from PubChem (CID 69232482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).