(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride

C15H24ClNO2 — CID 166634040

IUPAC(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride
SMILESCOc1ccc(OCCN2CCCC[C@H]2C)cc1.Cl
InChIInChI=1S/C15H23NO2.ClH/c1-13-5-3-4-10-16(13)11-12-18-15-8-6-14(17-2)7-9-15;/h6-9,13H,3-5,10-12H2,1-2H3;1H/t13-;/m1./s1
InChIKeyFCAHELGPUURFTR-BTQNPOSSSA-N
MW285.81 g/mol
LogP3.37
Rot. Bonds5

About (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride

(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride (PubChem CID 166634040) has the molecular formula C15H24ClNO2 and a molecular weight of 285.81 g/mol. Its IUPAC name is (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride.

Molecular Properties

Compound Name(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride
PubChem CID166634040
Molecular FormulaC15H24ClNO2
Molecular Weight285.81 g/mol
Exact Mass285.15
IUPAC Name(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride
SMILESCOc1ccc(OCCN2CCCC[C@H]2C)cc1.Cl
InChIInChI=1S/C15H23NO2.ClH/c1-13-5-3-4-10-16(13)11-12-18-15-8-6-14(17-2)7-9-15;/h6-9,13H,3-5,10-12H2,1-2H3;1H/t13-;/m1./s1
InChIKeyFCAHELGPUURFTR-BTQNPOSSSA-N
XLogP3.37
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.81
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Pramoxine
CID 4886
Domiphen Bromide
CID 10866
Pramoxine Hydrochloride
CID 73957
N,N-Dimethyl-N-(2-phenoxyethyl)-1-dodecanaminium
CID 3149
Guaiapate
CID 70066
1-(4-Phenoxybutyl)piperidine
CID 2057411
(2-Dimethylaminoethoxy)benzene
CID 26050
(S)-2-((4-phenoxyphenoxy)methyl)piperidine
CID 29293599
(R)-2-((4-phenoxyphenoxy)methyl)piperidine
CID 29293603
(R/S)-2-((4-phenoxyphenoxy)methyl)piperidine
CID 45253769
N,N-Dimethyl-2-(4-Phenoxyphenoxy)ethanamine
CID 87057595
Diethyl(2-phenoxyethyl)amine
CID 66150

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride?
The IUPAC name of (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride (CID 166634040) is (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride.
What is the SMILES notation for (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride?
The canonical SMILES for (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride is COc1ccc(OCCN2CCCC[C@H]2C)cc1.Cl.
What is the InChIKey of (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride?
The InChIKey is FCAHELGPUURFTR-BTQNPOSSSA-N. The full InChI is InChI=1S/C15H23NO2.ClH/c1-13-5-3-4-10-16(13)11-12-18-15-8-6-14(17-2)7-9-15;/h6-9,13H,3-5,10-12H2,1-2H3;1H/t13-;/m1./s1.
What are the key properties of (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride?
(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride has a molecular weight of 285.81 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine;hydrochloride is sourced from PubChem (CID 166634040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).