5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine

C15H22FN3O — CID 59506072

IUPAC5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine
SMILESFc1ccc(N2CCC(OC3CCNCC3)CC2)nc1
InChIInChI=1S/C15H22FN3O/c16-12-1-2-15(18-11-12)19-9-5-14(6-10-19)20-13-3-7-17-8-4-13/h1-2,11,13-14,17H,3-10H2
InChIKeySQDSUNQQDDVIKU-UHFFFAOYSA-N
MW279.36 g/mol
LogP1.96
Rot. Bonds3

About 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine

5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine (PubChem CID 59506072) has the molecular formula C15H22FN3O and a molecular weight of 279.36 g/mol. Its IUPAC name is 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine.

Molecular Properties

Compound Name5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine
PubChem CID59506072
Molecular FormulaC15H22FN3O
Molecular Weight279.36 g/mol
Exact Mass279.17
IUPAC Name5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine
SMILESFc1ccc(N2CCC(OC3CCNCC3)CC2)nc1
InChIInChI=1S/C15H22FN3O/c16-12-1-2-15(18-11-12)19-9-5-14(6-10-19)20-13-3-7-17-8-4-13/h1-2,11,13-14,17H,3-10H2
InChIKeySQDSUNQQDDVIKU-UHFFFAOYSA-N
XLogP1.96
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine?
The IUPAC name of 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine (CID 59506072) is 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine.
What is the SMILES notation for 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine?
The canonical SMILES for 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine is Fc1ccc(N2CCC(OC3CCNCC3)CC2)nc1.
What is the InChIKey of 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine?
The InChIKey is SQDSUNQQDDVIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O/c16-12-1-2-15(18-11-12)19-9-5-14(6-10-19)20-13-3-7-17-8-4-13/h1-2,11,13-14,17H,3-10H2.
What are the key properties of 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine?
5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine has a molecular weight of 279.36 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(4-piperidin-4-yloxypiperidin-1-yl)pyridine is sourced from PubChem (CID 59506072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).