4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine

C14H21NO2 — CID 117343038

IUPAC4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine
SMILESCOCc1cccc(C2CCNCC2)c1OC
InChIInChI=1S/C14H21NO2/c1-16-10-12-4-3-5-13(14(12)17-2)11-6-8-15-9-7-11/h3-5,11,15H,6-10H2,1-2H3
InChIKeyFUEINVFXPRZFIN-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.31
Rot. Bonds4

About 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine

4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine (PubChem CID 117343038) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine.

Molecular Properties

Compound Name4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine
PubChem CID117343038
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine
SMILESCOCc1cccc(C2CCNCC2)c1OC
InChIInChI=1S/C14H21NO2/c1-16-10-12-4-3-5-13(14(12)17-2)11-6-8-15-9-7-11/h3-5,11,15H,6-10H2,1-2H3
InChIKeyFUEINVFXPRZFIN-UHFFFAOYSA-N
XLogP2.31
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2,3-dimethoxy-4-(methoxymethyl)phenyl]pyrrolidine
CID 117381710
3-(methoxymethyl)-4-piperidin-4-ylaniline
CID 166120409
4-(4-chloro-2,3-dimethoxyphenyl)piperidine
CID 117392507
1-cyclohexyl-3-ethyl-2-methoxybenzene
CID 70191110
3-[4-fluoro-2-methoxy-3-(methoxymethyl)phenyl]pyrrolidine
CID 117351158
4-(2-methoxyphenyl)piperidine
CID 544738
4-[2-(piperidin-4-ylmethyl)phenyl]piperidine
CID 117399981
N-methoxy-1-(2-piperidin-4-ylphenyl)methanamine
CID 117314747
4-[3-fluoro-2-methoxy-5-(methoxymethyl)phenyl]piperidine
CID 117386422
4-(2,4-dimethoxy-3-methylsulfanylphenyl)piperidine
CID 117422234
4-[3-methoxy-4-(methoxymethyl)phenyl]piperidine
CID 117343039
2,3-dimethoxy-4-piperidin-4-ylpyridine
CID 84687723

Frequently Asked Questions

What is the IUPAC name of 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine?
The IUPAC name of 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine (CID 117343038) is 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine.
What is the SMILES notation for 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine?
The canonical SMILES for 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine is COCc1cccc(C2CCNCC2)c1OC.
What is the InChIKey of 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine?
The InChIKey is FUEINVFXPRZFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-16-10-12-4-3-5-13(14(12)17-2)11-6-8-15-9-7-11/h3-5,11,15H,6-10H2,1-2H3.
What are the key properties of 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine?
4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine has a molecular weight of 235.33 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine is sourced from PubChem (CID 117343038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).