2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol

C18H22O2 — CID 63018668

IUPAC2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
SMILESCOc1cc(C(O)Cc2cc(C)ccc2C)ccc1C
InChIInChI=1S/C18H22O2/c1-12-5-6-13(2)16(9-12)10-17(19)15-8-7-14(3)18(11-15)20-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyUQRTYAWHTNIUTO-UHFFFAOYSA-N
MW270.37 g/mol
LogP3.90
Rot. Bonds4

About 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol

2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol (PubChem CID 63018668) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
PubChem CID63018668
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
SMILESCOc1cc(C(O)Cc2cc(C)ccc2C)ccc1C
InChIInChI=1S/C18H22O2/c1-12-5-6-13(2)16(9-12)10-17(19)15-8-7-14(3)18(11-15)20-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyUQRTYAWHTNIUTO-UHFFFAOYSA-N
XLogP3.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dimethylphenyl)-1-(4-methylphenyl)ethanol
CID 61481687
1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol
CID 62537711
2-(2-bromophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 114977277
1-(4-fluoro-3-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 62160340
2-(2,5-dimethylphenyl)-1-(6-methoxy-3-pyridinyl)ethanol
CID 114938079
2-(2,5-dimethylphenyl)-1-(4-fluoro-3-methylphenyl)ethanol
CID 61482044
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 65101453
2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol
CID 115819121
1-(3-bromo-4-ethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol
CID 104661074
2-(3-chloro-2-fluorophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 102867481
2-(2-methoxy-5-methylphenyl)-1-(6-methyl-3-pyridinyl)ethanol
CID 104822975
[1-(4-chloro-3-methoxyphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105320864

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol (CID 63018668) is 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol is COc1cc(C(O)Cc2cc(C)ccc2C)ccc1C.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol?
The InChIKey is UQRTYAWHTNIUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-12-5-6-13(2)16(9-12)10-17(19)15-8-7-14(3)18(11-15)20-4/h5-9,11,17,19H,10H2,1-4H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol?
2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol has a molecular weight of 270.37 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol is sourced from PubChem (CID 63018668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).