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

C10H20N2O3 — CID 57350018

IUPAC2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol
SMILESCN1C=CN(CCOCCOCCO)C1
InChIInChI=1S/C10H20N2O3/c1-11-2-3-12(10-11)4-6-14-8-9-15-7-5-13/h2-3,13H,4-10H2,1H3
InChIKeyVSUQGNKXYGQODI-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.31
Rot. Bonds8

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

2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol (PubChem CID 57350018) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol
PubChem CID57350018
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol
SMILESCN1C=CN(CCOCCOCCO)C1
InChIInChI=1S/C10H20N2O3/c1-11-2-3-12(10-11)4-6-14-8-9-15-7-5-13/h2-3,13H,4-10H2,1H3
InChIKeyVSUQGNKXYGQODI-UHFFFAOYSA-N
XLogP-0.31
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.31
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 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol (CID 57350018) is 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol is CN1C=CN(CCOCCOCCO)C1.
What is the InChIKey of 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol?
The InChIKey is VSUQGNKXYGQODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-11-2-3-12(10-11)4-6-14-8-9-15-7-5-13/h2-3,13H,4-10H2,1H3.
What are the key properties of 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol?
2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol has a molecular weight of 216.28 g/mol, XLogP of -0.31, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(3-methyl-2H-imidazol-1-yl)ethoxy]ethoxy]ethanol is sourced from PubChem (CID 57350018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).