2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol

C11H11N5O — CID 121214931

IUPAC2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol
SMILESOCCn1ccn2nc(-c3cnccn3)cc12
InChIInChI=1S/C11H11N5O/c17-6-5-15-3-4-16-11(15)7-9(14-16)10-8-12-1-2-13-10/h1-4,7-8,17H,5-6H2
InChIKeyCSAOTYIDHHDZKO-UHFFFAOYSA-N
MW229.24 g/mol
LogP0.59
Rot. Bonds3

About 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol

2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol (PubChem CID 121214931) has the molecular formula C11H11N5O and a molecular weight of 229.24 g/mol. Its IUPAC name is 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol
PubChem CID121214931
Molecular FormulaC11H11N5O
Molecular Weight229.24 g/mol
Exact Mass229.10
IUPAC Name2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol
SMILESOCCn1ccn2nc(-c3cnccn3)cc12
InChIInChI=1S/C11H11N5O/c17-6-5-15-3-4-16-11(15)7-9(14-16)10-8-12-1-2-13-10/h1-4,7-8,17H,5-6H2
InChIKeyCSAOTYIDHHDZKO-UHFFFAOYSA-N
XLogP0.59
TPSA68.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol?
The IUPAC name of 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol (CID 121214931) is 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol.
What is the SMILES notation for 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol?
The canonical SMILES for 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol is OCCn1ccn2nc(-c3cnccn3)cc12.
What is the InChIKey of 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol?
The InChIKey is CSAOTYIDHHDZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O/c17-6-5-15-3-4-16-11(15)7-9(14-16)10-8-12-1-2-13-10/h1-4,7-8,17H,5-6H2.
What are the key properties of 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol?
2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol has a molecular weight of 229.24 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyrazin-2-ylimidazo[2,1-e]pyrazol-1-yl)ethanol is sourced from PubChem (CID 121214931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).