5-ethenyl-2-methylpyridine

C8H9N — CID 8817

IUPAC5-ethenyl-2-methylpyridine
SMILESC=Cc1ccc(C)nc1
InChIInChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3
InChIKeyVJOWMORERYNYON-UHFFFAOYSA-N
MW119.17 g/mol
LogP2.03
Rot. Bonds1

About 5-ethenyl-2-methylpyridine

5-ethenyl-2-methylpyridine (PubChem CID 8817) has the molecular formula C8H9N and a molecular weight of 119.17 g/mol. Its IUPAC name is 5-ethenyl-2-methylpyridine.

Molecular Properties

Compound Name5-ethenyl-2-methylpyridine
PubChem CID8817
Molecular FormulaC8H9N
Molecular Weight119.17 g/mol
Exact Mass119.07
IUPAC Name5-ethenyl-2-methylpyridine
SMILESC=Cc1ccc(C)nc1
InChIInChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3
InChIKeyVJOWMORERYNYON-UHFFFAOYSA-N
XLogP2.03
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.17
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-2-methylpyridine?
The IUPAC name of 5-ethenyl-2-methylpyridine (CID 8817) is 5-ethenyl-2-methylpyridine.
What is the SMILES notation for 5-ethenyl-2-methylpyridine?
The canonical SMILES for 5-ethenyl-2-methylpyridine is C=Cc1ccc(C)nc1.
What is the InChIKey of 5-ethenyl-2-methylpyridine?
The InChIKey is VJOWMORERYNYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3.
What are the key properties of 5-ethenyl-2-methylpyridine?
5-ethenyl-2-methylpyridine has a molecular weight of 119.17 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-2-methylpyridine is sourced from PubChem (CID 8817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).