2-(2-methylidenecyclohexyl)pyrazine

C11H14N2 — CID 123937147

IUPAC2-(2-methylidenecyclohexyl)pyrazine
SMILESC=C1CCCCC1c1cnccn1
InChIInChI=1S/C11H14N2/c1-9-4-2-3-5-10(9)11-8-12-6-7-13-11/h6-8,10H,1-5H2
InChIKeyXBKHVUIBKZQABG-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.69
Rot. Bonds1

About 2-(2-methylidenecyclohexyl)pyrazine

2-(2-methylidenecyclohexyl)pyrazine (PubChem CID 123937147) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2-(2-methylidenecyclohexyl)pyrazine.

Molecular Properties

Compound Name2-(2-methylidenecyclohexyl)pyrazine
PubChem CID123937147
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2-(2-methylidenecyclohexyl)pyrazine
SMILESC=C1CCCCC1c1cnccn1
InChIInChI=1S/C11H14N2/c1-9-4-2-3-5-10(9)11-8-12-6-7-13-11/h6-8,10H,1-5H2
InChIKeyXBKHVUIBKZQABG-UHFFFAOYSA-N
XLogP2.69
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylidenecyclohexyl)pyrazine?
The IUPAC name of 2-(2-methylidenecyclohexyl)pyrazine (CID 123937147) is 2-(2-methylidenecyclohexyl)pyrazine.
What is the SMILES notation for 2-(2-methylidenecyclohexyl)pyrazine?
The canonical SMILES for 2-(2-methylidenecyclohexyl)pyrazine is C=C1CCCCC1c1cnccn1.
What is the InChIKey of 2-(2-methylidenecyclohexyl)pyrazine?
The InChIKey is XBKHVUIBKZQABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-9-4-2-3-5-10(9)11-8-12-6-7-13-11/h6-8,10H,1-5H2.
What are the key properties of 2-(2-methylidenecyclohexyl)pyrazine?
2-(2-methylidenecyclohexyl)pyrazine has a molecular weight of 174.25 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylidenecyclohexyl)pyrazine is sourced from PubChem (CID 123937147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).