[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol

C12H20N2O5 — CID 104564158

IUPAC[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol
SMILESCOCCOCCOCCOc1cncc(CO)n1
InChIInChI=1S/C12H20N2O5/c1-16-2-3-17-4-5-18-6-7-19-12-9-13-8-11(10-15)14-12/h8-9,15H,2-7,10H2,1H3
InChIKeyXEULODMRTGSBFU-UHFFFAOYSA-N
MW272.30 g/mol
LogP0.03
Rot. Bonds11

About [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol

[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol (PubChem CID 104564158) has the molecular formula C12H20N2O5 and a molecular weight of 272.30 g/mol. Its IUPAC name is [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol
PubChem CID104564158
Molecular FormulaC12H20N2O5
Molecular Weight272.30 g/mol
Exact Mass272.14
IUPAC Name[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol
SMILESCOCCOCCOCCOc1cncc(CO)n1
InChIInChI=1S/C12H20N2O5/c1-16-2-3-17-4-5-18-6-7-19-12-9-13-8-11(10-15)14-12/h8-9,15H,2-7,10H2,1H3
InChIKeyXEULODMRTGSBFU-UHFFFAOYSA-N
XLogP0.03
TPSA82.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol?
The IUPAC name of [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol (CID 104564158) is [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol.
What is the SMILES notation for [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol?
The canonical SMILES for [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol is COCCOCCOCCOc1cncc(CO)n1.
What is the InChIKey of [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol?
The InChIKey is XEULODMRTGSBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O5/c1-16-2-3-17-4-5-18-6-7-19-12-9-13-8-11(10-15)14-12/h8-9,15H,2-7,10H2,1H3.
What are the key properties of [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol?
[6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol has a molecular weight of 272.30 g/mol, XLogP of 0.03, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrazin-2-yl]methanol is sourced from PubChem (CID 104564158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).