2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine

C15H23NO2 — CID 70628177

IUPAC2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine
SMILESCOc1cccc(OCCC2CCCCN2C)c1
InChIInChI=1S/C15H23NO2/c1-16-10-4-3-6-13(16)9-11-18-15-8-5-7-14(12-15)17-2/h5,7-8,12-13H,3-4,6,9-11H2,1-2H3
InChIKeyHADZTDPLWIGDEM-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.95
Rot. Bonds5

About 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine

2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine (PubChem CID 70628177) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine.

Molecular Properties

Compound Name2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine
PubChem CID70628177
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine
SMILESCOc1cccc(OCCC2CCCCN2C)c1
InChIInChI=1S/C15H23NO2/c1-16-10-4-3-6-13(16)9-11-18-15-8-5-7-14(12-15)17-2/h5,7-8,12-13H,3-4,6,9-11H2,1-2H3
InChIKeyHADZTDPLWIGDEM-UHFFFAOYSA-N
XLogP2.95
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-2-(2-phenoxyethyl)piperidine
CID 23339547
2-[2-(3-ethylphenoxy)ethyl]-1-methylpiperidine
CID 103616830
[3-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methanamine
CID 106485036
(1R)-1-[3-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]ethanol
CID 107912832
3-[3-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]prop-2-yn-1-ol
CID 107913130
2-[2-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]ethyl]-1-methylpiperidine;hydrochloride
CID 57497623
3-[2-(1-methylpyrrolidin-2-yl)ethoxy]benzoic acid
CID 102823660
1-[4-methoxy-2-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]ethanone
CID 103801800
1-[3-[2-(1-methylpyrrolidin-2-yl)ethoxy]phenyl]ethanone
CID 79168162
3-[2-(1-methylpiperidin-2-yl)ethoxy]benzenecarboximidamide
CID 107912530
2-[2-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]ethyl]-1-methylpyrrolidine
CID 15896863
1-[2-bromo-5-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]-N-methylmethanamine
CID 107911135

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine?
The IUPAC name of 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine (CID 70628177) is 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine.
What is the SMILES notation for 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine?
The canonical SMILES for 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine is COc1cccc(OCCC2CCCCN2C)c1.
What is the InChIKey of 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine?
The InChIKey is HADZTDPLWIGDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-16-10-4-3-6-13(16)9-11-18-15-8-5-7-14(12-15)17-2/h5,7-8,12-13H,3-4,6,9-11H2,1-2H3.
What are the key properties of 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine?
2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine has a molecular weight of 249.35 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine is sourced from PubChem (CID 70628177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).