2-(3-methoxypiperidin-1-yl)-6-methylpyrazine

C11H17N3O — CID 133470094

IUPAC2-(3-methoxypiperidin-1-yl)-6-methylpyrazine
SMILESCOC1CCCN(c2cncc(C)n2)C1
InChIInChI=1S/C11H17N3O/c1-9-6-12-7-11(13-9)14-5-3-4-10(8-14)15-2/h6-7,10H,3-5,8H2,1-2H3
InChIKeyNNNIHUFYVRZFNZ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.40
Rot. Bonds2

About 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine

2-(3-methoxypiperidin-1-yl)-6-methylpyrazine (PubChem CID 133470094) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine.

Molecular Properties

Compound Name2-(3-methoxypiperidin-1-yl)-6-methylpyrazine
PubChem CID133470094
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-(3-methoxypiperidin-1-yl)-6-methylpyrazine
SMILESCOC1CCCN(c2cncc(C)n2)C1
InChIInChI=1S/C11H17N3O/c1-9-6-12-7-11(13-9)14-5-3-4-10(8-14)15-2/h6-7,10H,3-5,8H2,1-2H3
InChIKeyNNNIHUFYVRZFNZ-UHFFFAOYSA-N
XLogP1.40
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine?
The IUPAC name of 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine (CID 133470094) is 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine.
What is the SMILES notation for 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine?
The canonical SMILES for 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine is COC1CCCN(c2cncc(C)n2)C1.
What is the InChIKey of 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine?
The InChIKey is NNNIHUFYVRZFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-6-12-7-11(13-9)14-5-3-4-10(8-14)15-2/h6-7,10H,3-5,8H2,1-2H3.
What are the key properties of 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine?
2-(3-methoxypiperidin-1-yl)-6-methylpyrazine has a molecular weight of 207.28 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypiperidin-1-yl)-6-methylpyrazine is sourced from PubChem (CID 133470094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).