2-benzyl-6-(1-methylpiperidin-4-yl)pyridine

C18H22N2 — CID 95808909

IUPAC2-benzyl-6-(1-methylpiperidin-4-yl)pyridine
SMILESCN1CCC(c2cccc(Cc3ccccc3)n2)CC1
InChIInChI=1S/C18H22N2/c1-20-12-10-16(11-13-20)18-9-5-8-17(19-18)14-15-6-3-2-4-7-15/h2-9,16H,10-14H2,1H3
InChIKeyQIZJPZGVFLHBSM-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.48
Rot. Bonds3

About 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine

2-benzyl-6-(1-methylpiperidin-4-yl)pyridine (PubChem CID 95808909) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine.

Molecular Properties

Compound Name2-benzyl-6-(1-methylpiperidin-4-yl)pyridine
PubChem CID95808909
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name2-benzyl-6-(1-methylpiperidin-4-yl)pyridine
SMILESCN1CCC(c2cccc(Cc3ccccc3)n2)CC1
InChIInChI=1S/C18H22N2/c1-20-12-10-16(11-13-20)18-9-5-8-17(19-18)14-15-6-3-2-4-7-15/h2-9,16H,10-14H2,1H3
InChIKeyQIZJPZGVFLHBSM-UHFFFAOYSA-N
XLogP3.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-benzyl-6-(1-methylpiperidin-4-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 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine?
The IUPAC name of 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine (CID 95808909) is 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine.
What is the SMILES notation for 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine?
The canonical SMILES for 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine is CN1CCC(c2cccc(Cc3ccccc3)n2)CC1.
What is the InChIKey of 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine?
The InChIKey is QIZJPZGVFLHBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-20-12-10-16(11-13-20)18-9-5-8-17(19-18)14-15-6-3-2-4-7-15/h2-9,16H,10-14H2,1H3.
What are the key properties of 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine?
2-benzyl-6-(1-methylpiperidin-4-yl)pyridine has a molecular weight of 266.39 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-6-(1-methylpiperidin-4-yl)pyridine is sourced from PubChem (CID 95808909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).