1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane

C14H28O2 — CID 20692086

IUPAC1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane
SMILESCOCCOCC1(C)CC(C)CC(C)(C)C1
InChIInChI=1S/C14H28O2/c1-12-8-13(2,3)10-14(4,9-12)11-16-7-6-15-5/h12H,6-11H2,1-5H3
InChIKeyBXJAFIYDCPGLII-UHFFFAOYSA-N
MW228.38 g/mol
LogP3.50
Rot. Bonds5

About 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane

1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane (PubChem CID 20692086) has the molecular formula C14H28O2 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane.

Molecular Properties

Compound Name1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane
PubChem CID20692086
Molecular FormulaC14H28O2
Molecular Weight228.38 g/mol
Exact Mass228.21
IUPAC Name1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane
SMILESCOCCOCC1(C)CC(C)CC(C)(C)C1
InChIInChI=1S/C14H28O2/c1-12-8-13(2,3)10-14(4,9-12)11-16-7-6-15-5/h12H,6-11H2,1-5H3
InChIKeyBXJAFIYDCPGLII-UHFFFAOYSA-N
XLogP3.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane 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-(1-Ethoxyethyl)-1,1-dimethylcyclohexane
CID 9812955
1,1-Dimethyl-3-(1-propoxyethyl)cyclohexane
CID 9899112
2,2-Bis(methoxymethyl)pentylcyclohexane
CID 17830743
3-(2-Ethoxyethoxy)propylcyclohexane
CID 17975055
1-(1,2-Dimethoxyethyl)-1,3,3,5-tetramethylcyclohexane
CID 20692066
2-(2-Methoxyethoxy)-1,1,3,3,5-pentamethylcyclohexane
CID 20692133
4-(3,3-Dimethylbutyl)oxane
CID 21041534
3-(2,2-Dimethylpropyl)oxane
CID 21056551
[1-Ethoxy-3-methoxy-2-(methoxymethyl)propan-2-yl]cyclohexane
CID 21852221
1,1-Bis(methoxymethyl)cyclohexane
CID 22020788
1,1-Bis(ethoxymethyl)cyclohexane
CID 22372617
1,1-Dimethyl-3-[1-(2-methylpropoxy)ethyl]cyclohexane
CID 23025289

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane?
The IUPAC name of 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane (CID 20692086) is 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane.
What is the SMILES notation for 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane?
The canonical SMILES for 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane is COCCOCC1(C)CC(C)CC(C)(C)C1.
What is the InChIKey of 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane?
The InChIKey is BXJAFIYDCPGLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2/c1-12-8-13(2,3)10-14(4,9-12)11-16-7-6-15-5/h12H,6-11H2,1-5H3.
What are the key properties of 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane?
1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane has a molecular weight of 228.38 g/mol, XLogP of 3.50, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxymethyl)-1,3,3,5-tetramethylcyclohexane is sourced from PubChem (CID 20692086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).