2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine

C15H23NO2 — CID 43146765

IUPAC2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine
SMILESCOc1cccc(CCC2CCCCN2)c1OC
InChIInChI=1S/C15H23NO2/c1-17-14-8-5-6-12(15(14)18-2)9-10-13-7-3-4-11-16-13/h5-6,8,13,16H,3-4,7,9-11H2,1-2H3
InChIKeyFKJAWCBAGDULSB-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.78
Rot. Bonds5

About 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine

2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine (PubChem CID 43146765) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine.

Molecular Properties

Compound Name2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine
PubChem CID43146765
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine
SMILESCOc1cccc(CCC2CCCCN2)c1OC
InChIInChI=1S/C15H23NO2/c1-17-14-8-5-6-12(15(14)18-2)9-10-13-7-3-4-11-16-13/h5-6,8,13,16H,3-4,7,9-11H2,1-2H3
InChIKeyFKJAWCBAGDULSB-UHFFFAOYSA-N
XLogP2.78
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2,3-dimethoxyphenoxy)ethyl]piperidine
CID 112500840
1-(2-cyclohexylethyl)-2,3-dimethoxybenzene
CID 140989777
1-methoxynaphthalene;4-piperidin-2-ylbutanoic acid
CID 143873908
2-[(2,3,6-trimethoxyphenyl)methyl]piperidine
CID 117417665
2-[(2-cyclopropyloxy-3-methoxyphenyl)methyl]pyrrolidine
CID 117371410
N-[(2,3-dimethoxyphenyl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119708902
1-(2-methoxyphenyl)-4-piperidin-2-ylbutan-2-one
CID 116563786
2-[2-(3-methoxyphenyl)ethyl]azepane
CID 113443145
2-[[2-methoxy-3-(thiolan-3-yloxy)phenyl]methyl]piperidine
CID 117492500
1-(2-fluoro-3-methoxyphenyl)-4-piperidin-2-ylbutan-2-one
CID 116563754
2-[[3-methoxy-2-(oxan-4-yloxy)phenyl]methyl]piperidine
CID 117490817
CID 142470178
CID 142470178

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine?
The IUPAC name of 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine (CID 43146765) is 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine.
What is the SMILES notation for 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine?
The canonical SMILES for 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine is COc1cccc(CCC2CCCCN2)c1OC.
What is the InChIKey of 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine?
The InChIKey is FKJAWCBAGDULSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-14-8-5-6-12(15(14)18-2)9-10-13-7-3-4-11-16-13/h5-6,8,13,16H,3-4,7,9-11H2,1-2H3.
What are the key properties of 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine?
2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine has a molecular weight of 249.35 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,3-dimethoxyphenyl)ethyl]piperidine is sourced from PubChem (CID 43146765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).