3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine

C16H25NO2 — CID 82303319

IUPAC3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine
SMILESCOc1ccc(OC)c(C2(C)CNCC(C)(C)C2)c1
InChIInChI=1S/C16H25NO2/c1-15(2)9-16(3,11-17-10-15)13-8-12(18-4)6-7-14(13)19-5/h6-8,17H,9-11H2,1-5H3
InChIKeyDAUXPKLBJLZQFT-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.98
Rot. Bonds3

About 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine

3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine (PubChem CID 82303319) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine.

Molecular Properties

Compound Name3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine
PubChem CID82303319
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine
SMILESCOc1ccc(OC)c(C2(C)CNCC(C)(C)C2)c1
InChIInChI=1S/C16H25NO2/c1-15(2)9-16(3,11-17-10-15)13-8-12(18-4)6-7-14(13)19-5/h6-8,17H,9-11H2,1-5H3
InChIKeyDAUXPKLBJLZQFT-UHFFFAOYSA-N
XLogP2.98
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine 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

4-(2,5-dimethoxyphenyl)-4-methylpiperidine
CID 63156571
3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine
CID 82290208
4-(2,5-dimethoxyphenyl)piperidine-4-carboxylic acid
CID 82091719
4-(2,5-dimethoxyphenyl)-4-methyloxane-2,6-dione
CID 82133552
1-(2,5-dimethoxyphenyl)-3,3-dimethylcyclopentan-1-ol
CID 80699237
3-(2,5-dimethoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538682
2-(3-chloro-1-methylcyclopentyl)-1,4-dimethoxybenzene
CID 116540274
2-(1-chloro-2,2,3,3-tetramethylcyclopropyl)-1,4-dimethoxybenzene
CID 15162635
3-(5-bromo-2-methoxyphenyl)-3-methylpyrrolidine
CID 83693943
[2-(2,5-dimethoxyphenyl)-1,3-dioxan-2-yl]methanamine
CID 79017767
6-[(2,4-dimethoxyphenyl)methyl]-6-methyl-1,4-diazepane
CID 82486393
3-(5-fluoro-2-methoxyphenyl)azetidin-3-amine
CID 166607967

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine?
The IUPAC name of 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine (CID 82303319) is 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine.
What is the SMILES notation for 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine?
The canonical SMILES for 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine is COc1ccc(OC)c(C2(C)CNCC(C)(C)C2)c1.
What is the InChIKey of 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine?
The InChIKey is DAUXPKLBJLZQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-15(2)9-16(3,11-17-10-15)13-8-12(18-4)6-7-14(13)19-5/h6-8,17H,9-11H2,1-5H3.
What are the key properties of 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine?
3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine has a molecular weight of 263.38 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine is sourced from PubChem (CID 82303319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).