2-fluoro-6-prop-2-enoxypyridine

C8H8FNO — CID 61227601

IUPAC2-fluoro-6-prop-2-enoxypyridine
SMILESC=CCOc1cccc(F)n1
InChIInChI=1S/C8H8FNO/c1-2-6-11-8-5-3-4-7(9)10-8/h2-5H,1,6H2
InChIKeyVSYCOJWIIOFQOC-UHFFFAOYSA-N
MW153.16 g/mol
LogP1.79
Rot. Bonds3

About 2-fluoro-6-prop-2-enoxypyridine

2-fluoro-6-prop-2-enoxypyridine (PubChem CID 61227601) has the molecular formula C8H8FNO and a molecular weight of 153.16 g/mol. Its IUPAC name is 2-fluoro-6-prop-2-enoxypyridine.

Molecular Properties

Compound Name2-fluoro-6-prop-2-enoxypyridine
PubChem CID61227601
Molecular FormulaC8H8FNO
Molecular Weight153.16 g/mol
Exact Mass153.06
IUPAC Name2-fluoro-6-prop-2-enoxypyridine
SMILESC=CCOc1cccc(F)n1
InChIInChI=1S/C8H8FNO/c1-2-6-11-8-5-3-4-7(9)10-8/h2-5H,1,6H2
InChIKeyVSYCOJWIIOFQOC-UHFFFAOYSA-N
XLogP1.79
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.16
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-prop-2-enoxypyridine?
The IUPAC name of 2-fluoro-6-prop-2-enoxypyridine (CID 61227601) is 2-fluoro-6-prop-2-enoxypyridine.
What is the SMILES notation for 2-fluoro-6-prop-2-enoxypyridine?
The canonical SMILES for 2-fluoro-6-prop-2-enoxypyridine is C=CCOc1cccc(F)n1.
What is the InChIKey of 2-fluoro-6-prop-2-enoxypyridine?
The InChIKey is VSYCOJWIIOFQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO/c1-2-6-11-8-5-3-4-7(9)10-8/h2-5H,1,6H2.
What are the key properties of 2-fluoro-6-prop-2-enoxypyridine?
2-fluoro-6-prop-2-enoxypyridine has a molecular weight of 153.16 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-prop-2-enoxypyridine is sourced from PubChem (CID 61227601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).