2-prop-2-enylpyridine

C8H9N — CID 3015241

IUPAC2-prop-2-enylpyridine
SMILESC=CCc1ccccn1
InChIInChI=1S/C8H9N/c1-2-5-8-6-3-4-7-9-8/h2-4,6-7H,1,5H2
InChIKeyLIPRUDRQZVPYCL-UHFFFAOYSA-N
MW119.17 g/mol
LogP1.81
Rot. Bonds2

About 2-prop-2-enylpyridine

2-prop-2-enylpyridine (PubChem CID 3015241) has the molecular formula C8H9N and a molecular weight of 119.17 g/mol. Its IUPAC name is 2-prop-2-enylpyridine.

Molecular Properties

Compound Name2-prop-2-enylpyridine
PubChem CID3015241
Molecular FormulaC8H9N
Molecular Weight119.17 g/mol
Exact Mass119.07
IUPAC Name2-prop-2-enylpyridine
SMILESC=CCc1ccccn1
InChIInChI=1S/C8H9N/c1-2-5-8-6-3-4-7-9-8/h2-4,6-7H,1,5H2
InChIKeyLIPRUDRQZVPYCL-UHFFFAOYSA-N
XLogP1.81
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.17
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 66669094
CID 66669094
2-prop-2-enylpyridine;tributyl(fluoro)stannane
CID 174480224
hexadecyl(trimethyl)azanium;2-prop-2-enylpyridine;chloride
CID 174935769
1-N,1-N'-bis(prop-2-enyl)-3-pyridin-2-ylprop-1-ene-1,1-diamine
CID 67443317
2-oct-7-enylpyridine
CID 57031977
2-prop-2-enylpyrimidine
CID 20526273
2-(3-pyridin-4-ylprop-2-enyl)pyridine
CID 175215086
2-(3,3-dimethylhept-6-enyl)pyridine
CID 91019951
3-prop-2-enyl-2-pyridin-2-ylpyridine
CID 66633912
N-propyl-2-pyridin-2-ylethanimine
CID 66967042
N-(pyridin-2-ylmethyl)hex-5-en-2-amine
CID 75525482
2-(pyridin-2-ylmethylsulfanylmethyl)pyridine
CID 12047870

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enylpyridine?
The IUPAC name of 2-prop-2-enylpyridine (CID 3015241) is 2-prop-2-enylpyridine.
What is the SMILES notation for 2-prop-2-enylpyridine?
The canonical SMILES for 2-prop-2-enylpyridine is C=CCc1ccccn1.
What is the InChIKey of 2-prop-2-enylpyridine?
The InChIKey is LIPRUDRQZVPYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N/c1-2-5-8-6-3-4-7-9-8/h2-4,6-7H,1,5H2.
What are the key properties of 2-prop-2-enylpyridine?
2-prop-2-enylpyridine has a molecular weight of 119.17 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enylpyridine is sourced from PubChem (CID 3015241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).