4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine

C15H23NO3 — CID 117417648

IUPAC4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine
SMILESCOCc1c(OC)ccc(OC)c1C1CCNCC1
InChIInChI=1S/C15H23NO3/c1-17-10-12-13(18-2)4-5-14(19-3)15(12)11-6-8-16-9-7-11/h4-5,11,16H,6-10H2,1-3H3
InChIKeyUNZNVMYSZXXRGE-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.32
Rot. Bonds5

About 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine

4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine (PubChem CID 117417648) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine.

Molecular Properties

Compound Name4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine
PubChem CID117417648
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine
SMILESCOCc1c(OC)ccc(OC)c1C1CCNCC1
InChIInChI=1S/C15H23NO3/c1-17-10-12-13(18-2)4-5-14(19-3)15(12)11-6-8-16-9-7-11/h4-5,11,16H,6-10H2,1-3H3
InChIKeyUNZNVMYSZXXRGE-UHFFFAOYSA-N
XLogP2.32
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-methoxy-4-(methoxymethyl)phenyl]piperidine
CID 117343039
3-fluoro-4-methoxy-2-piperidin-4-ylphenol
CID 84790129
4-(2-chloro-6-fluoro-3-methoxyphenyl)piperidine
CID 84802229
4-[5-(2,2-dimethylpropyl)-2-methoxyphenyl]piperidine
CID 117408603
4-(2-methoxyphenyl)piperidine
CID 544738
3-fluoro-5-methoxy-4-piperidin-4-ylphenol
CID 84790128
3-[[2,4-dimethoxy-3-(methoxymethyl)phenyl]methyl]piperidine
CID 117448288
3-[4-fluoro-2-methoxy-3-(methoxymethyl)phenyl]pyrrolidine
CID 117351158
4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine
CID 117343038
3-(2-bromo-6-methoxy-3-methylphenyl)pyrrolidine
CID 84808969
4-(2,4-dichloro-6-methoxyphenyl)piperidine
CID 156722732
4-[[4-(methoxymethyl)phenyl]methyl]piperidine
CID 84786985

Frequently Asked Questions

What is the IUPAC name of 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine?
The IUPAC name of 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine (CID 117417648) is 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine.
What is the SMILES notation for 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine?
The canonical SMILES for 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine is COCc1c(OC)ccc(OC)c1C1CCNCC1.
What is the InChIKey of 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine?
The InChIKey is UNZNVMYSZXXRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-17-10-12-13(18-2)4-5-14(19-3)15(12)11-6-8-16-9-7-11/h4-5,11,16H,6-10H2,1-3H3.
What are the key properties of 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine?
4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine has a molecular weight of 265.35 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3,6-dimethoxy-2-(methoxymethyl)phenyl]piperidine is sourced from PubChem (CID 117417648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).