3-ethenylpyridine

C7H7N — CID 14272

IUPAC3-ethenylpyridine
SMILESC=Cc1cccnc1
InChIInChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InChIKeyDPZYLEIWHTWHCU-UHFFFAOYSA-N
MW105.14 g/mol
LogP1.72
Rot. Bonds1

About 3-ethenylpyridine

3-ethenylpyridine (PubChem CID 14272) has the molecular formula C7H7N and a molecular weight of 105.14 g/mol. Its IUPAC name is 3-ethenylpyridine.

Molecular Properties

Compound Name3-ethenylpyridine
PubChem CID14272
Molecular FormulaC7H7N
Molecular Weight105.14 g/mol
Exact Mass105.06
IUPAC Name3-ethenylpyridine
SMILESC=Cc1cccnc1
InChIInChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InChIKeyDPZYLEIWHTWHCU-UHFFFAOYSA-N
XLogP1.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.14
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethenylpyridine?
The IUPAC name of 3-ethenylpyridine (CID 14272) is 3-ethenylpyridine.
What is the SMILES notation for 3-ethenylpyridine?
The canonical SMILES for 3-ethenylpyridine is C=Cc1cccnc1.
What is the InChIKey of 3-ethenylpyridine?
The InChIKey is DPZYLEIWHTWHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2.
What are the key properties of 3-ethenylpyridine?
3-ethenylpyridine has a molecular weight of 105.14 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenylpyridine is sourced from PubChem (CID 14272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).