2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine

C12H14FNO — CID 135044755

IUPAC2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine
SMILESC=C(C)C1(Oc2cccc(F)n2)CCC1
InChIInChI=1S/C12H14FNO/c1-9(2)12(7-4-8-12)15-11-6-3-5-10(13)14-11/h3,5-6H,1,4,7-8H2,2H3
InChIKeySDGXHRLNKAEZCG-UHFFFAOYSA-N
MW207.25 g/mol
LogP3.10
Rot. Bonds3

About 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine

2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine (PubChem CID 135044755) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine.

Molecular Properties

Compound Name2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine
PubChem CID135044755
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine
SMILESC=C(C)C1(Oc2cccc(F)n2)CCC1
InChIInChI=1S/C12H14FNO/c1-9(2)12(7-4-8-12)15-11-6-3-5-10(13)14-11/h3,5-6H,1,4,7-8H2,2H3
InChIKeySDGXHRLNKAEZCG-UHFFFAOYSA-N
XLogP3.10
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 53.10
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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Related Compounds

2-tert-Butoxy-6-chloropyridine
CID 11984350
2-Bromo-6-tert-butoxypyridine
CID 29919811
Pyridine, 2-ethoxy-6-methyl-
CID 4738465
2-Fluoro-6-methoxypyridine
CID 14296367
2-tert-Butoxypyridine
CID 14491562
2-(Difluoromethoxy)-6-fluoropyridine
CID 26985479
2-Ethoxy-6-fluoropyridine
CID 53424555
2-Fluoro-6-(propan-2-yloxy)pyridine
CID 61229350
2-Fluoro-6-methoxy-4-methylpyridine
CID 89099872
3,6-Difluoro-2-methoxypyridine
CID 66936867
3-Fluoro-2,6-dimethoxypyridine
CID 130784380
6-Methoxy-2,3-dimethylpyridine
CID 23423791

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine?
The IUPAC name of 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine (CID 135044755) is 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine.
What is the SMILES notation for 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine?
The canonical SMILES for 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine is C=C(C)C1(Oc2cccc(F)n2)CCC1.
What is the InChIKey of 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine?
The InChIKey is SDGXHRLNKAEZCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-9(2)12(7-4-8-12)15-11-6-3-5-10(13)14-11/h3,5-6H,1,4,7-8H2,2H3.
What are the key properties of 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine?
2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine has a molecular weight of 207.25 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(1-prop-1-en-2-ylcyclobutyl)oxypyridine is sourced from PubChem (CID 135044755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).