3-naphthalen-2-ylpiperidine;hydrochloride

C15H18ClN — CID 45073830

IUPAC3-naphthalen-2-ylpiperidine;hydrochloride
SMILESCl.c1ccc2cc(C3CCCNC3)ccc2c1
InChIInChI=1S/C15H17N.ClH/c1-2-5-13-10-14(8-7-12(13)4-1)15-6-3-9-16-11-15;/h1-2,4-5,7-8,10,15-16H,3,6,9,11H2;1H
InChIKeyNJKRUUVCXUZRGU-UHFFFAOYSA-N
MW247.77 g/mol
LogP3.73
Rot. Bonds1

About 3-naphthalen-2-ylpiperidine;hydrochloride

3-naphthalen-2-ylpiperidine;hydrochloride (PubChem CID 45073830) has the molecular formula C15H18ClN and a molecular weight of 247.77 g/mol. Its IUPAC name is 3-naphthalen-2-ylpiperidine;hydrochloride.

Molecular Properties

Compound Name3-naphthalen-2-ylpiperidine;hydrochloride
PubChem CID45073830
Molecular FormulaC15H18ClN
Molecular Weight247.77 g/mol
Exact Mass247.11
IUPAC Name3-naphthalen-2-ylpiperidine;hydrochloride
SMILESCl.c1ccc2cc(C3CCCNC3)ccc2c1
InChIInChI=1S/C15H17N.ClH/c1-2-5-13-10-14(8-7-12(13)4-1)15-6-3-9-16-11-15;/h1-2,4-5,7-8,10,15-16H,3,6,9,11H2;1H
InChIKeyNJKRUUVCXUZRGU-UHFFFAOYSA-N
XLogP3.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.77
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-ylpiperidine;hydrochloride?
The IUPAC name of 3-naphthalen-2-ylpiperidine;hydrochloride (CID 45073830) is 3-naphthalen-2-ylpiperidine;hydrochloride.
What is the SMILES notation for 3-naphthalen-2-ylpiperidine;hydrochloride?
The canonical SMILES for 3-naphthalen-2-ylpiperidine;hydrochloride is Cl.c1ccc2cc(C3CCCNC3)ccc2c1.
What is the InChIKey of 3-naphthalen-2-ylpiperidine;hydrochloride?
The InChIKey is NJKRUUVCXUZRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N.ClH/c1-2-5-13-10-14(8-7-12(13)4-1)15-6-3-9-16-11-15;/h1-2,4-5,7-8,10,15-16H,3,6,9,11H2;1H.
What are the key properties of 3-naphthalen-2-ylpiperidine;hydrochloride?
3-naphthalen-2-ylpiperidine;hydrochloride has a molecular weight of 247.77 g/mol, XLogP of 3.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-ylpiperidine;hydrochloride is sourced from PubChem (CID 45073830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).