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

C12H17FN2 — CID 62123107

IUPAC2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine
SMILESCC1CCCN(c2cccc(F)n2)C1C
InChIInChI=1S/C12H17FN2/c1-9-5-4-8-15(10(9)2)12-7-3-6-11(13)14-12/h3,6-7,9-10H,4-5,8H2,1-2H3
InChIKeyUNHQPFSQJIXPGC-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.85
Rot. Bonds1

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

2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine (PubChem CID 62123107) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine.

Molecular Properties

Compound Name2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine
PubChem CID62123107
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine
SMILESCC1CCCN(c2cccc(F)n2)C1C
InChIInChI=1S/C12H17FN2/c1-9-5-4-8-15(10(9)2)12-7-3-6-11(13)14-12/h3,6-7,9-10H,4-5,8H2,1-2H3
InChIKeyUNHQPFSQJIXPGC-UHFFFAOYSA-N
XLogP2.85
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.85
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-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine?
The IUPAC name of 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine (CID 62123107) is 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine.
What is the SMILES notation for 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine?
The canonical SMILES for 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine is CC1CCCN(c2cccc(F)n2)C1C.
What is the InChIKey of 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine?
The InChIKey is UNHQPFSQJIXPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-9-5-4-8-15(10(9)2)12-7-3-6-11(13)14-12/h3,6-7,9-10H,4-5,8H2,1-2H3.
What are the key properties of 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine?
2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine has a molecular weight of 208.28 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylpiperidin-1-yl)-6-fluoropyridine is sourced from PubChem (CID 62123107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).