4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine

C24H28N2 — CID 70410875

IUPAC4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine
SMILESCCC1CCC(CCc2cccc3ccccc23)N(c2ccncc2)C1
InChIInChI=1S/C24H28N2/c1-2-19-10-12-22(26(18-19)23-14-16-25-17-15-23)13-11-21-8-5-7-20-6-3-4-9-24(20)21/h3-9,14-17,19,22H,2,10-13,18H2,1H3
InChIKeyUBDMZPWASMWUTK-UHFFFAOYSA-N
MW344.50 g/mol
LogP5.86
Rot. Bonds5

About 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine

4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine (PubChem CID 70410875) has the molecular formula C24H28N2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine.

Molecular Properties

Compound Name4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine
PubChem CID70410875
Molecular FormulaC24H28N2
Molecular Weight344.50 g/mol
Exact Mass344.23
IUPAC Name4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine
SMILESCCC1CCC(CCc2cccc3ccccc23)N(c2ccncc2)C1
InChIInChI=1S/C24H28N2/c1-2-19-10-12-22(26(18-19)23-14-16-25-17-15-23)13-11-21-8-5-7-20-6-3-4-9-24(20)21/h3-9,14-17,19,22H,2,10-13,18H2,1H3
InChIKeyUBDMZPWASMWUTK-UHFFFAOYSA-N
XLogP5.86
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine?
The IUPAC name of 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine (CID 70410875) is 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine.
What is the SMILES notation for 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine?
The canonical SMILES for 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine is CCC1CCC(CCc2cccc3ccccc23)N(c2ccncc2)C1.
What is the InChIKey of 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine?
The InChIKey is UBDMZPWASMWUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2/c1-2-19-10-12-22(26(18-19)23-14-16-25-17-15-23)13-11-21-8-5-7-20-6-3-4-9-24(20)21/h3-9,14-17,19,22H,2,10-13,18H2,1H3.
What are the key properties of 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine?
4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine has a molecular weight of 344.50 g/mol, XLogP of 5.86, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-ethyl-2-(2-naphthalen-1-ylethyl)piperidin-1-yl]pyridine is sourced from PubChem (CID 70410875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).