5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride

C24H29ClN2 — CID 14441412

IUPAC5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride
SMILESCc1cnc(CCCc2cccc3ccccc23)cc1N1CCCCC1.Cl
InChIInChI=1S/C24H28N2.ClH/c1-19-18-25-22(17-24(19)26-15-5-2-6-16-26)13-8-12-21-11-7-10-20-9-3-4-14-23(20)21;/h3-4,7,9-11,14,17-18H,2,5-6,8,12-13,15-16H2,1H3;1H
InChIKeyTWHCXSIUBSNENO-UHFFFAOYSA-N
MW380.96 g/mol
LogP6.13
Rot. Bonds5

About 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride

5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride (PubChem CID 14441412) has the molecular formula C24H29ClN2 and a molecular weight of 380.96 g/mol. Its IUPAC name is 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride.

Molecular Properties

Compound Name5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride
PubChem CID14441412
Molecular FormulaC24H29ClN2
Molecular Weight380.96 g/mol
Exact Mass380.20
IUPAC Name5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride
SMILESCc1cnc(CCCc2cccc3ccccc23)cc1N1CCCCC1.Cl
InChIInChI=1S/C24H28N2.ClH/c1-19-18-25-22(17-24(19)26-15-5-2-6-16-26)13-8-12-21-11-7-10-20-9-3-4-14-23(20)21;/h3-4,7,9-11,14,17-18H,2,5-6,8,12-13,15-16H2,1H3;1H
InChIKeyTWHCXSIUBSNENO-UHFFFAOYSA-N
XLogP6.13
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.96
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride?
The IUPAC name of 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride (CID 14441412) is 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride.
What is the SMILES notation for 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride?
The canonical SMILES for 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride is Cc1cnc(CCCc2cccc3ccccc23)cc1N1CCCCC1.Cl.
What is the InChIKey of 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride?
The InChIKey is TWHCXSIUBSNENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2.ClH/c1-19-18-25-22(17-24(19)26-15-5-2-6-16-26)13-8-12-21-11-7-10-20-9-3-4-14-23(20)21;/h3-4,7,9-11,14,17-18H,2,5-6,8,12-13,15-16H2,1H3;1H.
What are the key properties of 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride?
5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride has a molecular weight of 380.96 g/mol, XLogP of 6.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-naphthalen-1-ylpropyl)-4-piperidin-1-ylpyridine;hydrochloride is sourced from PubChem (CID 14441412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).