5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine

C24H26N2 — CID 14441211

IUPAC5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine
SMILESCc1cnc(/C=C\c2cccc3c(C)cccc23)cc1N1CCCCC1
InChIInChI=1S/C24H26N2/c1-18-8-6-11-23-20(9-7-10-22(18)23)12-13-21-16-24(19(2)17-25-21)26-14-4-3-5-15-26/h6-13,16-17H,3-5,14-15H2,1-2H3/b13-12-
InChIKeyZVQVYKYGEVWENB-SEYXRHQNSA-N
MW342.49 g/mol
LogP6.01
Rot. Bonds3

About 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine

5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine (PubChem CID 14441211) has the molecular formula C24H26N2 and a molecular weight of 342.49 g/mol. Its IUPAC name is 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine.

Molecular Properties

Compound Name5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine
PubChem CID14441211
Molecular FormulaC24H26N2
Molecular Weight342.49 g/mol
Exact Mass342.21
IUPAC Name5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine
SMILESCc1cnc(/C=C\c2cccc3c(C)cccc23)cc1N1CCCCC1
InChIInChI=1S/C24H26N2/c1-18-8-6-11-23-20(9-7-10-22(18)23)12-13-21-16-24(19(2)17-25-21)26-14-4-3-5-15-26/h6-13,16-17H,3-5,14-15H2,1-2H3/b13-12-
InChIKeyZVQVYKYGEVWENB-SEYXRHQNSA-N
XLogP6.01
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.49
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine?
The IUPAC name of 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine (CID 14441211) is 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine.
What is the SMILES notation for 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine?
The canonical SMILES for 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine is Cc1cnc(/C=C\c2cccc3c(C)cccc23)cc1N1CCCCC1.
What is the InChIKey of 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine?
The InChIKey is ZVQVYKYGEVWENB-SEYXRHQNSA-N. The full InChI is InChI=1S/C24H26N2/c1-18-8-6-11-23-20(9-7-10-22(18)23)12-13-21-16-24(19(2)17-25-21)26-14-4-3-5-15-26/h6-13,16-17H,3-5,14-15H2,1-2H3/b13-12-.
What are the key properties of 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine?
5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine has a molecular weight of 342.49 g/mol, XLogP of 6.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(Z)-2-(5-methylnaphthalen-1-yl)ethenyl]-4-piperidin-1-ylpyridine is sourced from PubChem (CID 14441211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).