2-(propan-2-yloxymethyl)pyrazine

C8H12N2O — CID 23323031

IUPAC2-(propan-2-yloxymethyl)pyrazine
SMILESCC(C)OCc1cnccn1
InChIInChI=1S/C8H12N2O/c1-7(2)11-6-8-5-9-3-4-10-8/h3-5,7H,6H2,1-2H3
InChIKeyCPODUXYNEJIHRT-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.40
Rot. Bonds3

About 2-(propan-2-yloxymethyl)pyrazine

2-(propan-2-yloxymethyl)pyrazine (PubChem CID 23323031) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-(propan-2-yloxymethyl)pyrazine.

Molecular Properties

Compound Name2-(propan-2-yloxymethyl)pyrazine
PubChem CID23323031
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-(propan-2-yloxymethyl)pyrazine
SMILESCC(C)OCc1cnccn1
InChIInChI=1S/C8H12N2O/c1-7(2)11-6-8-5-9-3-4-10-8/h3-5,7H,6H2,1-2H3
InChIKeyCPODUXYNEJIHRT-UHFFFAOYSA-N
XLogP1.40
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 ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 113204
CID 113204
CID 3068148
CID 3068148
CID 3068149
CID 3068149
CID 103404
CID 103404
CID 172435817
CID 172435817
CID 14532641
CID 14532641
CID 421619
CID 421619
CID 470894
CID 470894
CID 12933345
CID 12933345
CID 13123637
CID 13123637
CID 14257640
CID 14257640
CID 14531221
CID 14531221

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-yloxymethyl)pyrazine?
The IUPAC name of 2-(propan-2-yloxymethyl)pyrazine (CID 23323031) is 2-(propan-2-yloxymethyl)pyrazine.
What is the SMILES notation for 2-(propan-2-yloxymethyl)pyrazine?
The canonical SMILES for 2-(propan-2-yloxymethyl)pyrazine is CC(C)OCc1cnccn1.
What is the InChIKey of 2-(propan-2-yloxymethyl)pyrazine?
The InChIKey is CPODUXYNEJIHRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-7(2)11-6-8-5-9-3-4-10-8/h3-5,7H,6H2,1-2H3.
What are the key properties of 2-(propan-2-yloxymethyl)pyrazine?
2-(propan-2-yloxymethyl)pyrazine has a molecular weight of 152.20 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-yloxymethyl)pyrazine is sourced from PubChem (CID 23323031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).