2-fluoro-6-(4-propylpiperidin-1-yl)pyridine

C13H19FN2 — CID 62205633

IUPAC2-fluoro-6-(4-propylpiperidin-1-yl)pyridine
SMILESCCCC1CCN(c2cccc(F)n2)CC1
InChIInChI=1S/C13H19FN2/c1-2-4-11-7-9-16(10-8-11)13-6-3-5-12(14)15-13/h3,5-6,11H,2,4,7-10H2,1H3
InChIKeyISVCFWVGTXPXBP-UHFFFAOYSA-N
MW222.31 g/mol
LogP3.24
Rot. Bonds3

About 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine

2-fluoro-6-(4-propylpiperidin-1-yl)pyridine (PubChem CID 62205633) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine.

Molecular Properties

Compound Name2-fluoro-6-(4-propylpiperidin-1-yl)pyridine
PubChem CID62205633
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name2-fluoro-6-(4-propylpiperidin-1-yl)pyridine
SMILESCCCC1CCN(c2cccc(F)n2)CC1
InChIInChI=1S/C13H19FN2/c1-2-4-11-7-9-16(10-8-11)13-6-3-5-12(14)15-13/h3,5-6,11H,2,4,7-10H2,1H3
InChIKeyISVCFWVGTXPXBP-UHFFFAOYSA-N
XLogP3.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-fluoro-6-(4-propylpiperidin-1-yl)pyridine?
The IUPAC name of 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine (CID 62205633) is 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine.
What is the SMILES notation for 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine?
The canonical SMILES for 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine is CCCC1CCN(c2cccc(F)n2)CC1.
What is the InChIKey of 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine?
The InChIKey is ISVCFWVGTXPXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-2-4-11-7-9-16(10-8-11)13-6-3-5-12(14)15-13/h3,5-6,11H,2,4,7-10H2,1H3.
What are the key properties of 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine?
2-fluoro-6-(4-propylpiperidin-1-yl)pyridine has a molecular weight of 222.31 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(4-propylpiperidin-1-yl)pyridine is sourced from PubChem (CID 62205633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).