3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine

C15H23NO2 — CID 63986374

IUPAC3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine
SMILESCOCc1cccc(OCCC2CCCNC2)c1
InChIInChI=1S/C15H23NO2/c1-17-12-14-4-2-6-15(10-14)18-9-7-13-5-3-8-16-11-13/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3
InChIKeyOZZMQLMBTDFSJS-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.60
Rot. Bonds6

About 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine

3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine (PubChem CID 63986374) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine.

Molecular Properties

Compound Name3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine
PubChem CID63986374
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine
SMILESCOCc1cccc(OCCC2CCCNC2)c1
InChIInChI=1S/C15H23NO2/c1-17-12-14-4-2-6-15(10-14)18-9-7-13-5-3-8-16-11-13/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3
InChIKeyOZZMQLMBTDFSJS-UHFFFAOYSA-N
XLogP2.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[2-(3-ethoxyphenoxy)ethyl]piperidine
CID 86321619
(3R)-3-[2-(3-tert-butylphenoxy)ethyl]piperidine
CID 86321202
3-[2-(3-chlorophenoxy)ethyl]piperidine
CID 22309129
(3R)-3-[2-(3-propan-2-ylphenoxy)ethyl]piperidine
CID 86321208
(3R)-3-(2-phenoxyethyl)piperidine
CID 26192392
(3S)-3-[2-(3-methoxyphenoxy)ethyl]pyrrolidine
CID 93080822
3-[2-(4-methylphenoxy)ethyl]piperidine
CID 45075559
3-[2-(2,6-dimethoxyphenoxy)ethyl]piperidine
CID 62356017
(3S)-3-[2-[(3-bromophenyl)methoxy]ethyl]piperidine
CID 86321717
3-[2-[(3-bromophenyl)methoxy]ethyl]piperidine
CID 56830508
(2R)-2-[[3-(methoxymethyl)phenoxy]methyl]pyrrolidine
CID 102820162
(3R)-3-[2-[(3,5-dimethoxyphenyl)methoxy]ethyl]piperidine
CID 86321802

Frequently Asked Questions

What is the IUPAC name of 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine?
The IUPAC name of 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine (CID 63986374) is 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine.
What is the SMILES notation for 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine?
The canonical SMILES for 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine is COCc1cccc(OCCC2CCCNC2)c1.
What is the InChIKey of 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine?
The InChIKey is OZZMQLMBTDFSJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-12-14-4-2-6-15(10-14)18-9-7-13-5-3-8-16-11-13/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3.
What are the key properties of 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine?
3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine has a molecular weight of 249.35 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine is sourced from PubChem (CID 63986374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).