5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine

C16H18FN3 — CID 110103363

IUPAC5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
SMILESFc1ccc(N2CCCC(Cc3cccnc3)C2)nc1
InChIInChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2
InChIKeyFXEQLFKYLPPLOR-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.07
Rot. Bonds3

About 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine

5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine (PubChem CID 110103363) has the molecular formula C16H18FN3 and a molecular weight of 271.34 g/mol. Its IUPAC name is 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine.

Molecular Properties

Compound Name5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
PubChem CID110103363
Molecular FormulaC16H18FN3
Molecular Weight271.34 g/mol
Exact Mass271.15
IUPAC Name5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
SMILESFc1ccc(N2CCCC(Cc3cccnc3)C2)nc1
InChIInChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2
InChIKeyFXEQLFKYLPPLOR-UHFFFAOYSA-N
XLogP3.07
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The IUPAC name of 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine (CID 110103363) is 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine.
What is the SMILES notation for 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The canonical SMILES for 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine is Fc1ccc(N2CCCC(Cc3cccnc3)C2)nc1.
What is the InChIKey of 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The InChIKey is FXEQLFKYLPPLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2.
What are the key properties of 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine has a molecular weight of 271.34 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine is sourced from PubChem (CID 110103363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).