2-methoxy-6-prop-2-enylpyridine

C9H11NO — CID 24722170

IUPAC2-methoxy-6-prop-2-enylpyridine
SMILESC=CCc1cccc(OC)n1
InChIInChI=1S/C9H11NO/c1-3-5-8-6-4-7-9(10-8)11-2/h3-4,6-7H,1,5H2,2H3
InChIKeyBSJFJABVHNHPMS-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.82
Rot. Bonds3

About 2-methoxy-6-prop-2-enylpyridine

2-methoxy-6-prop-2-enylpyridine (PubChem CID 24722170) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 2-methoxy-6-prop-2-enylpyridine.

Molecular Properties

Compound Name2-methoxy-6-prop-2-enylpyridine
PubChem CID24722170
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name2-methoxy-6-prop-2-enylpyridine
SMILESC=CCc1cccc(OC)n1
InChIInChI=1S/C9H11NO/c1-3-5-8-6-4-7-9(10-8)11-2/h3-4,6-7H,1,5H2,2H3
InChIKeyBSJFJABVHNHPMS-UHFFFAOYSA-N
XLogP1.82
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.82
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-methoxy-6-prop-2-enylpyridine?
The IUPAC name of 2-methoxy-6-prop-2-enylpyridine (CID 24722170) is 2-methoxy-6-prop-2-enylpyridine.
What is the SMILES notation for 2-methoxy-6-prop-2-enylpyridine?
The canonical SMILES for 2-methoxy-6-prop-2-enylpyridine is C=CCc1cccc(OC)n1.
What is the InChIKey of 2-methoxy-6-prop-2-enylpyridine?
The InChIKey is BSJFJABVHNHPMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-3-5-8-6-4-7-9(10-8)11-2/h3-4,6-7H,1,5H2,2H3.
What are the key properties of 2-methoxy-6-prop-2-enylpyridine?
2-methoxy-6-prop-2-enylpyridine has a molecular weight of 149.19 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-prop-2-enylpyridine is sourced from PubChem (CID 24722170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).