3-(6-ethyl-2,3-dimethoxyphenyl)piperidine

C15H23NO2 — CID 117376940

IUPAC3-(6-ethyl-2,3-dimethoxyphenyl)piperidine
SMILESCCc1ccc(OC)c(OC)c1C1CCCNC1
InChIInChI=1S/C15H23NO2/c1-4-11-7-8-13(17-2)15(18-3)14(11)12-6-5-9-16-10-12/h7-8,12,16H,4-6,9-10H2,1-3H3
InChIKeyPVZFVUWMHIYQSC-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.73
Rot. Bonds4

About 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine

3-(6-ethyl-2,3-dimethoxyphenyl)piperidine (PubChem CID 117376940) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine.

Molecular Properties

Compound Name3-(6-ethyl-2,3-dimethoxyphenyl)piperidine
PubChem CID117376940
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name3-(6-ethyl-2,3-dimethoxyphenyl)piperidine
SMILESCCc1ccc(OC)c(OC)c1C1CCCNC1
InChIInChI=1S/C15H23NO2/c1-4-11-7-8-13(17-2)15(18-3)14(11)12-6-5-9-16-10-12/h7-8,12,16H,4-6,9-10H2,1-3H3
InChIKeyPVZFVUWMHIYQSC-UHFFFAOYSA-N
XLogP2.73
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-chloro-3,4-dimethoxyphenyl)piperidine
CID 117392621
3-(3,4-dimethoxy-2,6-dimethylphenyl)piperidine
CID 117376942
3-(5-ethyl-4-fluoro-2-methoxyphenyl)piperidine
CID 117347386
3-(2-bromo-3,6-dimethoxy-4-methylphenyl)piperidine
CID 117499540
3-(2,4-dimethoxy-3-methylsulfanylphenyl)piperidine
CID 117422244
(3S)-3-(2,3-difluoro-4-methoxyphenyl)piperidine
CID 99945848
3-[[2,4-dimethoxy-3-(methoxymethyl)phenyl]methyl]piperidine
CID 117448288
4-bromo-2-methoxy-3-piperidin-3-ylphenol
CID 117460905
2-chloro-4-methoxy-3-piperidin-3-ylpyridine
CID 84690868
1-ethyl-3,4-dimethoxy-2-methylbenzene
CID 54293104
2-piperidin-3-yl-1-(2,3,4-trimethoxyphenyl)butan-1-one
CID 70348568
3-(3,4-dimethoxy-2-methylphenyl)pyrrolidine
CID 84686824

Frequently Asked Questions

What is the IUPAC name of 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine?
The IUPAC name of 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine (CID 117376940) is 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine.
What is the SMILES notation for 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine?
The canonical SMILES for 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine is CCc1ccc(OC)c(OC)c1C1CCCNC1.
What is the InChIKey of 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine?
The InChIKey is PVZFVUWMHIYQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-4-11-7-8-13(17-2)15(18-3)14(11)12-6-5-9-16-10-12/h7-8,12,16H,4-6,9-10H2,1-3H3.
What are the key properties of 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine?
3-(6-ethyl-2,3-dimethoxyphenyl)piperidine has a molecular weight of 249.35 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-ethyl-2,3-dimethoxyphenyl)piperidine is sourced from PubChem (CID 117376940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).