5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine

C13H15FN4 — CID 83124993

IUPAC5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine
SMILESFc1ccc(-c2cnc(C3CCCCN3)[nH]2)nc1
InChIInChI=1S/C13H15FN4/c14-9-4-5-10(16-7-9)12-8-17-13(18-12)11-3-1-2-6-15-11/h4-5,7-8,11,15H,1-3,6H2,(H,17,18)
InChIKeyPSMOGSFZBONAQN-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.43
Rot. Bonds2

About 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine

5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine (PubChem CID 83124993) has the molecular formula C13H15FN4 and a molecular weight of 246.29 g/mol. Its IUPAC name is 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine.

Molecular Properties

Compound Name5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine
PubChem CID83124993
Molecular FormulaC13H15FN4
Molecular Weight246.29 g/mol
Exact Mass246.13
IUPAC Name5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine
SMILESFc1ccc(-c2cnc(C3CCCCN3)[nH]2)nc1
InChIInChI=1S/C13H15FN4/c14-9-4-5-10(16-7-9)12-8-17-13(18-12)11-3-1-2-6-15-11/h4-5,7-8,11,15H,1-3,6H2,(H,17,18)
InChIKeyPSMOGSFZBONAQN-UHFFFAOYSA-N
XLogP2.43
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine?
The IUPAC name of 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine (CID 83124993) is 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine.
What is the SMILES notation for 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine?
The canonical SMILES for 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine is Fc1ccc(-c2cnc(C3CCCCN3)[nH]2)nc1.
What is the InChIKey of 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine?
The InChIKey is PSMOGSFZBONAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4/c14-9-4-5-10(16-7-9)12-8-17-13(18-12)11-3-1-2-6-15-11/h4-5,7-8,11,15H,1-3,6H2,(H,17,18).
What are the key properties of 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine?
5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine has a molecular weight of 246.29 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(2-piperidin-2-yl-1H-imidazol-5-yl)pyridine is sourced from PubChem (CID 83124993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).