3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol

C12H18O2 — CID 58599740

IUPAC3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol
SMILESCCc1cc(COC)c(C)c(O)c1C
InChIInChI=1S/C12H18O2/c1-5-10-6-11(7-14-4)9(3)12(13)8(10)2/h6,13H,5,7H2,1-4H3
InChIKeyHQVQWJPOKRHJDT-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.72
Rot. Bonds3

About 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol

3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol (PubChem CID 58599740) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol.

Molecular Properties

Compound Name3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol
PubChem CID58599740
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol
SMILESCCc1cc(COC)c(C)c(O)c1C
InChIInChI=1S/C12H18O2/c1-5-10-6-11(7-14-4)9(3)12(13)8(10)2/h6,13H,5,7H2,1-4H3
InChIKeyHQVQWJPOKRHJDT-UHFFFAOYSA-N
XLogP2.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol 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

3,5-diethyl-2,6-dimethylphenol
CID 23451688
2-ethyl-3,5-bis(methoxymethyl)-6-methylphenol
CID 59672204
2,4-diethyl-5,7,10-tris(methoxymethyl)anthracene-1,8,9-triol
CID 158330008
4-[1-(3,5-diethyl-4-hydroxyphenyl)-2,2-bis[4-hydroxy-3,5-bis(methoxymethyl)phenyl]ethyl]-2,6-diethylphenol
CID 118593438
2,4-bis(methoxymethyl)-5-methylphenol
CID 176835467
1-[2,4-dihydroxy-6-(methoxymethyl)-3-methylphenyl]ethanone
CID 46894081
4-[[4-[bis[4-hydroxy-3,5-bis(methoxymethyl)phenyl]methyl]phenyl]-(3,5-diethyl-4-hydroxyphenyl)methyl]-2,6-diethylphenol
CID 118593439
5-ethyl-4-methylbenzene-1,3-diol
CID 12815574
2-ethyl-4-heptan-4-yl-6-(methoxymethyl)phenol
CID 143920624
ethene;1-ethyl-2-(methoxymethyl)-4-methylbenzene
CID 143093796
4-methoxy-2,6-bis(methoxymethyl)phenol
CID 138470113
2,3-dihydroxy-6-(methoxymethyl)-4-methylbenzaldehyde
CID 150672330

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol?
The IUPAC name of 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol (CID 58599740) is 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol.
What is the SMILES notation for 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol?
The canonical SMILES for 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol is CCc1cc(COC)c(C)c(O)c1C.
What is the InChIKey of 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol?
The InChIKey is HQVQWJPOKRHJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-5-10-6-11(7-14-4)9(3)12(13)8(10)2/h6,13H,5,7H2,1-4H3.
What are the key properties of 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol?
3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol has a molecular weight of 194.27 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(methoxymethyl)-2,6-dimethylphenol is sourced from PubChem (CID 58599740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).