4-benzyl-2-methyl-6-piperidin-3-ylpyridine

C18H22N2 — CID 110252935

IUPAC4-benzyl-2-methyl-6-piperidin-3-ylpyridine
SMILESCc1cc(Cc2ccccc2)cc(C2CCCNC2)n1
InChIInChI=1S/C18H22N2/c1-14-10-16(11-15-6-3-2-4-7-15)12-18(20-14)17-8-5-9-19-13-17/h2-4,6-7,10,12,17,19H,5,8-9,11,13H2,1H3
InChIKeyAYUOKNICEACXLO-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.45
Rot. Bonds3

About 4-benzyl-2-methyl-6-piperidin-3-ylpyridine

4-benzyl-2-methyl-6-piperidin-3-ylpyridine (PubChem CID 110252935) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-benzyl-2-methyl-6-piperidin-3-ylpyridine.

Molecular Properties

Compound Name4-benzyl-2-methyl-6-piperidin-3-ylpyridine
PubChem CID110252935
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name4-benzyl-2-methyl-6-piperidin-3-ylpyridine
SMILESCc1cc(Cc2ccccc2)cc(C2CCCNC2)n1
InChIInChI=1S/C18H22N2/c1-14-10-16(11-15-6-3-2-4-7-15)12-18(20-14)17-8-5-9-19-13-17/h2-4,6-7,10,12,17,19H,5,8-9,11,13H2,1H3
InChIKeyAYUOKNICEACXLO-UHFFFAOYSA-N
XLogP3.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-methyl-6-piperidin-3-ylpyridine?
The IUPAC name of 4-benzyl-2-methyl-6-piperidin-3-ylpyridine (CID 110252935) is 4-benzyl-2-methyl-6-piperidin-3-ylpyridine.
What is the SMILES notation for 4-benzyl-2-methyl-6-piperidin-3-ylpyridine?
The canonical SMILES for 4-benzyl-2-methyl-6-piperidin-3-ylpyridine is Cc1cc(Cc2ccccc2)cc(C2CCCNC2)n1.
What is the InChIKey of 4-benzyl-2-methyl-6-piperidin-3-ylpyridine?
The InChIKey is AYUOKNICEACXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-14-10-16(11-15-6-3-2-4-7-15)12-18(20-14)17-8-5-9-19-13-17/h2-4,6-7,10,12,17,19H,5,8-9,11,13H2,1H3.
What are the key properties of 4-benzyl-2-methyl-6-piperidin-3-ylpyridine?
4-benzyl-2-methyl-6-piperidin-3-ylpyridine has a molecular weight of 266.39 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-methyl-6-piperidin-3-ylpyridine is sourced from PubChem (CID 110252935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).