3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol

C15H24O3 — CID 114228362

IUPAC3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol
SMILESCOc1cc(C)c(C(C)(O)C(C)(C)OC)cc1C
InChIInChI=1S/C15H24O3/c1-10-9-13(17-6)11(2)8-12(10)15(5,16)14(3,4)18-7/h8-9,16H,1-7H3
InChIKeyJRYNWSYCGZTLCC-UHFFFAOYSA-N
MW252.35 g/mol
LogP2.94
Rot. Bonds4

About 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol

3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol (PubChem CID 114228362) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol.

Molecular Properties

Compound Name3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol
PubChem CID114228362
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol
SMILESCOc1cc(C)c(C(C)(O)C(C)(C)OC)cc1C
InChIInChI=1S/C15H24O3/c1-10-9-13(17-6)11(2)8-12(10)15(5,16)14(3,4)18-7/h8-9,16H,1-7H3
InChIKeyJRYNWSYCGZTLCC-UHFFFAOYSA-N
XLogP2.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-tert-butyl-4-methoxy-2,5-dimethylbenzene
CID 23345325
3-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-one
CID 82286345
2-(2,5-dimethoxy-4-methylphenyl)propan-2-ol;ethane
CID 145081658
4-(4-methoxy-2,5-dimethylphenyl)heptan-4-ol
CID 114866082
1,2-ditert-butyl-4-methoxy-5-methylbenzene
CID 90688741
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
1,1-difluoro-1-(4-methoxy-2,5-dimethylphenyl)-2-methylpropan-2-amine
CID 116839392
ethane;1-methoxy-2,4,5-trimethylbenzene
CID 143418687
3-hydroxy-3-(4-methoxy-2,5-dimethylphenyl)pentanoic acid
CID 82049543
4,4-difluoro-4-(4-methoxy-2,5-dimethylphenyl)-2-methylbutan-2-amine
CID 116839527
1-(2-fluorophenyl)-2-(4-methoxy-2,5-dimethylphenyl)propan-2-ol
CID 114832876
1-(4-methoxy-2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 82303353

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol?
The IUPAC name of 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol (CID 114228362) is 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol.
What is the SMILES notation for 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol?
The canonical SMILES for 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol is COc1cc(C)c(C(C)(O)C(C)(C)OC)cc1C.
What is the InChIKey of 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol?
The InChIKey is JRYNWSYCGZTLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3/c1-10-9-13(17-6)11(2)8-12(10)15(5,16)14(3,4)18-7/h8-9,16H,1-7H3.
What are the key properties of 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol?
3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol has a molecular weight of 252.35 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(4-methoxy-2,5-dimethylphenyl)-3-methylbutan-2-ol is sourced from PubChem (CID 114228362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).