1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol

C19H24O2 — CID 62549935

IUPAC1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H24O2/c1-18(2,3)14-10-12-15(13-11-14)19(4,20)16-8-6-7-9-17(16)21-5/h6-13,20H,1-5H3
InChIKeyIXFZRTVHZVGSNN-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.25
Rot. Bonds3

About 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol

1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol (PubChem CID 62549935) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
PubChem CID62549935
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H24O2/c1-18(2,3)14-10-12-15(13-11-14)19(4,20)16-8-6-7-9-17(16)21-5/h6-13,20H,1-5H3
InChIKeyIXFZRTVHZVGSNN-UHFFFAOYSA-N
XLogP4.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol (CID 62549935) is 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol is COc1ccccc1C(C)(O)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol?
The InChIKey is IXFZRTVHZVGSNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-18(2,3)14-10-12-15(13-11-14)19(4,20)16-8-6-7-9-17(16)21-5/h6-13,20H,1-5H3.
What are the key properties of 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol?
1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol has a molecular weight of 284.40 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 62549935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).