5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine

C23H26N2 — CID 14501346

IUPAC5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine
SMILESCc1cnc(CCc2ccc3ccccc3c2)cc1N1CCCCC1
InChIInChI=1S/C23H26N2/c1-18-17-24-22(16-23(18)25-13-5-2-6-14-25)12-10-19-9-11-20-7-3-4-8-21(20)15-19/h3-4,7-9,11,15-17H,2,5-6,10,12-14H2,1H3
InChIKeyHZELHCKBKBFQJQ-UHFFFAOYSA-N
MW330.48 g/mol
LogP5.32
Rot. Bonds4

About 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine

5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine (PubChem CID 14501346) has the molecular formula C23H26N2 and a molecular weight of 330.48 g/mol. Its IUPAC name is 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine.

Molecular Properties

Compound Name5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine
PubChem CID14501346
Molecular FormulaC23H26N2
Molecular Weight330.48 g/mol
Exact Mass330.21
IUPAC Name5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine
SMILESCc1cnc(CCc2ccc3ccccc3c2)cc1N1CCCCC1
InChIInChI=1S/C23H26N2/c1-18-17-24-22(16-23(18)25-13-5-2-6-14-25)12-10-19-9-11-20-7-3-4-8-21(20)15-19/h3-4,7-9,11,15-17H,2,5-6,10,12-14H2,1H3
InChIKeyHZELHCKBKBFQJQ-UHFFFAOYSA-N
XLogP5.32
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.48
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine?
The IUPAC name of 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine (CID 14501346) is 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine.
What is the SMILES notation for 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine?
The canonical SMILES for 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine is Cc1cnc(CCc2ccc3ccccc3c2)cc1N1CCCCC1.
What is the InChIKey of 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine?
The InChIKey is HZELHCKBKBFQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2/c1-18-17-24-22(16-23(18)25-13-5-2-6-14-25)12-10-19-9-11-20-7-3-4-8-21(20)15-19/h3-4,7-9,11,15-17H,2,5-6,10,12-14H2,1H3.
What are the key properties of 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine?
5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine has a molecular weight of 330.48 g/mol, XLogP of 5.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-naphthalen-2-ylethyl)-4-piperidin-1-ylpyridine is sourced from PubChem (CID 14501346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).