2-(6-methylpyrazin-2-yl)oxyacetic acid

C7H8N2O3 — CID 146908338

IUPAC2-(6-methylpyrazin-2-yl)oxyacetic acid
SMILESCc1cncc(OCC(=O)O)n1
InChIInChI=1S/C7H8N2O3/c1-5-2-8-3-6(9-5)12-4-7(10)11/h2-3H,4H2,1H3,(H,10,11)
InChIKeyAAURWOWMMNLINB-UHFFFAOYSA-N
MW168.15 g/mol
LogP0.25
Rot. Bonds3

About 2-(6-methylpyrazin-2-yl)oxyacetic acid

2-(6-methylpyrazin-2-yl)oxyacetic acid (PubChem CID 146908338) has the molecular formula C7H8N2O3 and a molecular weight of 168.15 g/mol. Its IUPAC name is 2-(6-methylpyrazin-2-yl)oxyacetic acid.

Molecular Properties

Compound Name2-(6-methylpyrazin-2-yl)oxyacetic acid
PubChem CID146908338
Molecular FormulaC7H8N2O3
Molecular Weight168.15 g/mol
Exact Mass168.05
IUPAC Name2-(6-methylpyrazin-2-yl)oxyacetic acid
SMILESCc1cncc(OCC(=O)O)n1
InChIInChI=1S/C7H8N2O3/c1-5-2-8-3-6(9-5)12-4-7(10)11/h2-3H,4H2,1H3,(H,10,11)
InChIKeyAAURWOWMMNLINB-UHFFFAOYSA-N
XLogP0.25
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methylpyrazin-2-yl)oxyacetic acid?
The IUPAC name of 2-(6-methylpyrazin-2-yl)oxyacetic acid (CID 146908338) is 2-(6-methylpyrazin-2-yl)oxyacetic acid.
What is the SMILES notation for 2-(6-methylpyrazin-2-yl)oxyacetic acid?
The canonical SMILES for 2-(6-methylpyrazin-2-yl)oxyacetic acid is Cc1cncc(OCC(=O)O)n1.
What is the InChIKey of 2-(6-methylpyrazin-2-yl)oxyacetic acid?
The InChIKey is AAURWOWMMNLINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3/c1-5-2-8-3-6(9-5)12-4-7(10)11/h2-3H,4H2,1H3,(H,10,11).
What are the key properties of 2-(6-methylpyrazin-2-yl)oxyacetic acid?
2-(6-methylpyrazin-2-yl)oxyacetic acid has a molecular weight of 168.15 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylpyrazin-2-yl)oxyacetic acid is sourced from PubChem (CID 146908338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).