2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol

C14H22O3 — CID 116711995

IUPAC2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol
SMILESCOc1ccc(C(O)C(OC)C(C)C)c(C)c1
InChIInChI=1S/C14H22O3/c1-9(2)14(17-5)13(15)12-7-6-11(16-4)8-10(12)3/h6-9,13-15H,1-5H3
InChIKeyFZRZEEWARLIYMG-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.71
Rot. Bonds5

About 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol

2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol (PubChem CID 116711995) has the molecular formula C14H22O3 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol
PubChem CID116711995
Molecular FormulaC14H22O3
Molecular Weight238.33 g/mol
Exact Mass238.16
IUPAC Name2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol
SMILESCOc1ccc(C(O)C(OC)C(C)C)c(C)c1
InChIInChI=1S/C14H22O3/c1-9(2)14(17-5)13(15)12-7-6-11(16-4)8-10(12)3/h6-9,13-15H,1-5H3
InChIKeyFZRZEEWARLIYMG-UHFFFAOYSA-N
XLogP2.71
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dimethylphenyl)-2-methoxy-3-methylbutan-1-ol
CID 116711931
2,2-dichloro-1-(4-methoxy-2-methylphenyl)ethanol
CID 164892247
1-(4-methoxy-2-methylphenyl)-2-methylsulfonylpropan-1-ol
CID 113422305
2,3-dihydroxy-3-(4-methoxy-2-methylphenyl)propanoic acid
CID 170823897
2-methoxy-3-methyl-1-(4-methyl-3-pyridinyl)butan-1-ol
CID 116711939
1-(5-methoxy-2-methylphenyl)ethanol
CID 84652412
1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 13147116
(2,5-dimethylphenyl)-(4-methoxy-2-methylphenyl)methanol
CID 61101284
1-(4-methoxy-2-methylphenyl)-N,2-dimethylpropan-1-amine
CID 43482752
(4-methoxy-2-methylphenyl)-phenylmethanol
CID 61101114
[(2R,3R)-3-(4-methoxy-2-methylphenyl)butan-2-yl] (2S)-2-amino-3-methylbutanoate
CID 139473087
S-[2,3-dihydroxy-3-(4-methoxy-2-methylphenyl)propyl] ethanethioate
CID 170821864

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol?
The IUPAC name of 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol (CID 116711995) is 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol.
What is the SMILES notation for 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol?
The canonical SMILES for 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol is COc1ccc(C(O)C(OC)C(C)C)c(C)c1.
What is the InChIKey of 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol?
The InChIKey is FZRZEEWARLIYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O3/c1-9(2)14(17-5)13(15)12-7-6-11(16-4)8-10(12)3/h6-9,13-15H,1-5H3.
What are the key properties of 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol?
2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol has a molecular weight of 238.33 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(4-methoxy-2-methylphenyl)-3-methylbutan-1-ol is sourced from PubChem (CID 116711995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).