2-(1,3-dioxolan-2-yl)-6-fluoropyridine

C8H8FNO2 — CID 10559050

IUPAC2-(1,3-dioxolan-2-yl)-6-fluoropyridine
SMILESFc1cccc(C2OCCO2)n1
InChIInChI=1S/C8H8FNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2
InChIKeyOHYTXCKVXJMLOK-UHFFFAOYSA-N
MW169.16 g/mol
LogP1.27
Rot. Bonds1

About 2-(1,3-dioxolan-2-yl)-6-fluoropyridine

2-(1,3-dioxolan-2-yl)-6-fluoropyridine (PubChem CID 10559050) has the molecular formula C8H8FNO2 and a molecular weight of 169.16 g/mol. Its IUPAC name is 2-(1,3-dioxolan-2-yl)-6-fluoropyridine.

Molecular Properties

Compound Name2-(1,3-dioxolan-2-yl)-6-fluoropyridine
PubChem CID10559050
Molecular FormulaC8H8FNO2
Molecular Weight169.16 g/mol
Exact Mass169.05
IUPAC Name2-(1,3-dioxolan-2-yl)-6-fluoropyridine
SMILESFc1cccc(C2OCCO2)n1
InChIInChI=1S/C8H8FNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2
InChIKeyOHYTXCKVXJMLOK-UHFFFAOYSA-N
XLogP1.27
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxolan-2-yl)-6-fluoropyridine?
The IUPAC name of 2-(1,3-dioxolan-2-yl)-6-fluoropyridine (CID 10559050) is 2-(1,3-dioxolan-2-yl)-6-fluoropyridine.
What is the SMILES notation for 2-(1,3-dioxolan-2-yl)-6-fluoropyridine?
The canonical SMILES for 2-(1,3-dioxolan-2-yl)-6-fluoropyridine is Fc1cccc(C2OCCO2)n1.
What is the InChIKey of 2-(1,3-dioxolan-2-yl)-6-fluoropyridine?
The InChIKey is OHYTXCKVXJMLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2.
What are the key properties of 2-(1,3-dioxolan-2-yl)-6-fluoropyridine?
2-(1,3-dioxolan-2-yl)-6-fluoropyridine has a molecular weight of 169.16 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxolan-2-yl)-6-fluoropyridine is sourced from PubChem (CID 10559050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).