2-(4-fluoropiperidin-4-yl)-5-propylpyridine

C13H19FN2 — CID 123706205

IUPAC2-(4-fluoropiperidin-4-yl)-5-propylpyridine
SMILESCCCc1ccc(C2(F)CCNCC2)nc1
InChIInChI=1S/C13H19FN2/c1-2-3-11-4-5-12(16-10-11)13(14)6-8-15-9-7-13/h4-5,10,15H,2-3,6-9H2,1H3
InChIKeyPKMGMZOYWUOPCP-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.58
Rot. Bonds3

About 2-(4-fluoropiperidin-4-yl)-5-propylpyridine

2-(4-fluoropiperidin-4-yl)-5-propylpyridine (PubChem CID 123706205) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-(4-fluoropiperidin-4-yl)-5-propylpyridine.

Molecular Properties

Compound Name2-(4-fluoropiperidin-4-yl)-5-propylpyridine
PubChem CID123706205
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name2-(4-fluoropiperidin-4-yl)-5-propylpyridine
SMILESCCCc1ccc(C2(F)CCNCC2)nc1
InChIInChI=1S/C13H19FN2/c1-2-3-11-4-5-12(16-10-11)13(14)6-8-15-9-7-13/h4-5,10,15H,2-3,6-9H2,1H3
InChIKeyPKMGMZOYWUOPCP-UHFFFAOYSA-N
XLogP2.58
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoropiperidin-4-yl)-5-propylpyridine?
The IUPAC name of 2-(4-fluoropiperidin-4-yl)-5-propylpyridine (CID 123706205) is 2-(4-fluoropiperidin-4-yl)-5-propylpyridine.
What is the SMILES notation for 2-(4-fluoropiperidin-4-yl)-5-propylpyridine?
The canonical SMILES for 2-(4-fluoropiperidin-4-yl)-5-propylpyridine is CCCc1ccc(C2(F)CCNCC2)nc1.
What is the InChIKey of 2-(4-fluoropiperidin-4-yl)-5-propylpyridine?
The InChIKey is PKMGMZOYWUOPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-2-3-11-4-5-12(16-10-11)13(14)6-8-15-9-7-13/h4-5,10,15H,2-3,6-9H2,1H3.
What are the key properties of 2-(4-fluoropiperidin-4-yl)-5-propylpyridine?
2-(4-fluoropiperidin-4-yl)-5-propylpyridine has a molecular weight of 222.31 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoropiperidin-4-yl)-5-propylpyridine is sourced from PubChem (CID 123706205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).