3-ethoxy-2-methylimidazo[1,2-a]pyrazine

C9H11N3O — CID 45091241

IUPAC3-ethoxy-2-methylimidazo[1,2-a]pyrazine
SMILESCCOc1c(C)nc2cnccn12
InChIInChI=1S/C9H11N3O/c1-3-13-9-7(2)11-8-6-10-4-5-12(8)9/h4-6H,3H2,1-2H3
InChIKeyMCLXYXHZHRETLQ-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.44
Rot. Bonds2

About 3-ethoxy-2-methylimidazo[1,2-a]pyrazine

3-ethoxy-2-methylimidazo[1,2-a]pyrazine (PubChem CID 45091241) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 3-ethoxy-2-methylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-ethoxy-2-methylimidazo[1,2-a]pyrazine
PubChem CID45091241
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name3-ethoxy-2-methylimidazo[1,2-a]pyrazine
SMILESCCOc1c(C)nc2cnccn12
InChIInChI=1S/C9H11N3O/c1-3-13-9-7(2)11-8-6-10-4-5-12(8)9/h4-6H,3H2,1-2H3
InChIKeyMCLXYXHZHRETLQ-UHFFFAOYSA-N
XLogP1.44
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-methylimidazo[1,2-a]pyrazine?
The IUPAC name of 3-ethoxy-2-methylimidazo[1,2-a]pyrazine (CID 45091241) is 3-ethoxy-2-methylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-ethoxy-2-methylimidazo[1,2-a]pyrazine?
The canonical SMILES for 3-ethoxy-2-methylimidazo[1,2-a]pyrazine is CCOc1c(C)nc2cnccn12.
What is the InChIKey of 3-ethoxy-2-methylimidazo[1,2-a]pyrazine?
The InChIKey is MCLXYXHZHRETLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-3-13-9-7(2)11-8-6-10-4-5-12(8)9/h4-6H,3H2,1-2H3.
What are the key properties of 3-ethoxy-2-methylimidazo[1,2-a]pyrazine?
3-ethoxy-2-methylimidazo[1,2-a]pyrazine has a molecular weight of 177.21 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-methylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 45091241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).