3-(3-piperidin-1-ylphenyl)pyridine

C16H18N2 — CID 166240155

IUPAC3-(3-piperidin-1-ylphenyl)pyridine
SMILESc1cncc(-c2cccc(N3CCCCC3)c2)c1
InChIInChI=1S/C16H18N2/c1-2-10-18(11-3-1)16-8-4-6-14(12-16)15-7-5-9-17-13-15/h4-9,12-13H,1-3,10-11H2
InChIKeyAJOFPDSDKMLXKP-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.74
Rot. Bonds2

About 3-(3-piperidin-1-ylphenyl)pyridine

3-(3-piperidin-1-ylphenyl)pyridine (PubChem CID 166240155) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-(3-piperidin-1-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(3-piperidin-1-ylphenyl)pyridine
PubChem CID166240155
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name3-(3-piperidin-1-ylphenyl)pyridine
SMILESc1cncc(-c2cccc(N3CCCCC3)c2)c1
InChIInChI=1S/C16H18N2/c1-2-10-18(11-3-1)16-8-4-6-14(12-16)15-7-5-9-17-13-15/h4-9,12-13H,1-3,10-11H2
InChIKeyAJOFPDSDKMLXKP-UHFFFAOYSA-N
XLogP3.74
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-piperidin-1-ylphenyl)pyridine?
The IUPAC name of 3-(3-piperidin-1-ylphenyl)pyridine (CID 166240155) is 3-(3-piperidin-1-ylphenyl)pyridine.
What is the SMILES notation for 3-(3-piperidin-1-ylphenyl)pyridine?
The canonical SMILES for 3-(3-piperidin-1-ylphenyl)pyridine is c1cncc(-c2cccc(N3CCCCC3)c2)c1.
What is the InChIKey of 3-(3-piperidin-1-ylphenyl)pyridine?
The InChIKey is AJOFPDSDKMLXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-2-10-18(11-3-1)16-8-4-6-14(12-16)15-7-5-9-17-13-15/h4-9,12-13H,1-3,10-11H2.
What are the key properties of 3-(3-piperidin-1-ylphenyl)pyridine?
3-(3-piperidin-1-ylphenyl)pyridine has a molecular weight of 238.33 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-piperidin-1-ylphenyl)pyridine is sourced from PubChem (CID 166240155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).