2-(ethoxymethyl)-5-methylpyrazine

C8H12N2O — CID 13446310

IUPAC2-(ethoxymethyl)-5-methylpyrazine
SMILESCCOCc1cnc(C)cn1
InChIInChI=1S/C8H12N2O/c1-3-11-6-8-5-9-7(2)4-10-8/h4-5H,3,6H2,1-2H3
InChIKeyACCAPTMHMGGYAA-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.32
Rot. Bonds3

About 2-(ethoxymethyl)-5-methylpyrazine

2-(ethoxymethyl)-5-methylpyrazine (PubChem CID 13446310) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-(ethoxymethyl)-5-methylpyrazine.

Molecular Properties

Compound Name2-(ethoxymethyl)-5-methylpyrazine
PubChem CID13446310
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-(ethoxymethyl)-5-methylpyrazine
SMILESCCOCc1cnc(C)cn1
InChIInChI=1S/C8H12N2O/c1-3-11-6-8-5-9-7(2)4-10-8/h4-5H,3,6H2,1-2H3
InChIKeyACCAPTMHMGGYAA-UHFFFAOYSA-N
XLogP1.32
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-5-methylpyrazine?
The IUPAC name of 2-(ethoxymethyl)-5-methylpyrazine (CID 13446310) is 2-(ethoxymethyl)-5-methylpyrazine.
What is the SMILES notation for 2-(ethoxymethyl)-5-methylpyrazine?
The canonical SMILES for 2-(ethoxymethyl)-5-methylpyrazine is CCOCc1cnc(C)cn1.
What is the InChIKey of 2-(ethoxymethyl)-5-methylpyrazine?
The InChIKey is ACCAPTMHMGGYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-3-11-6-8-5-9-7(2)4-10-8/h4-5H,3,6H2,1-2H3.
What are the key properties of 2-(ethoxymethyl)-5-methylpyrazine?
2-(ethoxymethyl)-5-methylpyrazine has a molecular weight of 152.20 g/mol, XLogP of 1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-5-methylpyrazine is sourced from PubChem (CID 13446310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).