2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol

C9H14N2O2 — CID 13368154

IUPAC2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol
SMILESCc1nc(CCO)cnc1CCO
InChIInChI=1S/C9H14N2O2/c1-7-9(3-5-13)10-6-8(11-7)2-4-12/h6,12-13H,2-5H2,1H3
InChIKeyYYASYPOIIGDZPS-UHFFFAOYSA-N
MW182.22 g/mol
LogP-0.15
Rot. Bonds4

About 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol

2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol (PubChem CID 13368154) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol.

Molecular Properties

Compound Name2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol
PubChem CID13368154
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol
SMILESCc1nc(CCO)cnc1CCO
InChIInChI=1S/C9H14N2O2/c1-7-9(3-5-13)10-6-8(11-7)2-4-12/h6,12-13H,2-5H2,1H3
InChIKeyYYASYPOIIGDZPS-UHFFFAOYSA-N
XLogP-0.15
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol?
The IUPAC name of 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol (CID 13368154) is 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol.
What is the SMILES notation for 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol?
The canonical SMILES for 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol is Cc1nc(CCO)cnc1CCO.
What is the InChIKey of 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol?
The InChIKey is YYASYPOIIGDZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7-9(3-5-13)10-6-8(11-7)2-4-12/h6,12-13H,2-5H2,1H3.
What are the key properties of 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol?
2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol has a molecular weight of 182.22 g/mol, XLogP of -0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-hydroxyethyl)-6-methylpyrazin-2-yl]ethanol is sourced from PubChem (CID 13368154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).