2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine

C12H16N2O — CID 134466079

IUPAC2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine
SMILESCOc1cncc(C2=CCC(C)CC2)n1
InChIInChI=1S/C12H16N2O/c1-9-3-5-10(6-4-9)11-7-13-8-12(14-11)15-2/h5,7-9H,3-4,6H2,1-2H3
InChIKeyLGPXEBWIQHGHHA-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.69
Rot. Bonds2

About 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine

2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine (PubChem CID 134466079) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine.

Molecular Properties

Compound Name2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine
PubChem CID134466079
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine
SMILESCOc1cncc(C2=CCC(C)CC2)n1
InChIInChI=1S/C12H16N2O/c1-9-3-5-10(6-4-9)11-7-13-8-12(14-11)15-2/h5,7-9H,3-4,6H2,1-2H3
InChIKeyLGPXEBWIQHGHHA-UHFFFAOYSA-N
XLogP2.69
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine?
The IUPAC name of 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine (CID 134466079) is 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine.
What is the SMILES notation for 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine?
The canonical SMILES for 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine is COc1cncc(C2=CCC(C)CC2)n1.
What is the InChIKey of 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine?
The InChIKey is LGPXEBWIQHGHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-9-3-5-10(6-4-9)11-7-13-8-12(14-11)15-2/h5,7-9H,3-4,6H2,1-2H3.
What are the key properties of 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine?
2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine has a molecular weight of 204.27 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(4-methylcyclohexen-1-yl)pyrazine is sourced from PubChem (CID 134466079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).