2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone

C7H8N2O2 — CID 121394382

IUPAC2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone
SMILESCc1cnc(C(=O)CO)cn1
InChIInChI=1S/C7H8N2O2/c1-5-2-9-6(3-8-5)7(11)4-10/h2-3,10H,4H2,1H3
InChIKeyIUMNNLONASVKDG-UHFFFAOYSA-N
MW152.15 g/mol
LogP-0.04
Rot. Bonds2

About 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone

2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone (PubChem CID 121394382) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone.

Molecular Properties

Compound Name2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone
PubChem CID121394382
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone
SMILESCc1cnc(C(=O)CO)cn1
InChIInChI=1S/C7H8N2O2/c1-5-2-9-6(3-8-5)7(11)4-10/h2-3,10H,4H2,1H3
InChIKeyIUMNNLONASVKDG-UHFFFAOYSA-N
XLogP-0.04
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone?
The IUPAC name of 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone (CID 121394382) is 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone.
What is the SMILES notation for 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone?
The canonical SMILES for 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone is Cc1cnc(C(=O)CO)cn1.
What is the InChIKey of 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone?
The InChIKey is IUMNNLONASVKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-5-2-9-6(3-8-5)7(11)4-10/h2-3,10H,4H2,1H3.
What are the key properties of 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone?
2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone has a molecular weight of 152.15 g/mol, XLogP of -0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(5-methylpyrazin-2-yl)ethanone is sourced from PubChem (CID 121394382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).