1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol

C18H22O3 — CID 104659510

IUPAC1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol
SMILESCOCCOc1ccccc1C(O)Cc1cccc(C)c1
InChIInChI=1S/C18H22O3/c1-14-6-5-7-15(12-14)13-17(19)16-8-3-4-9-18(16)21-11-10-20-2/h3-9,12,17,19H,10-11,13H2,1-2H3
InChIKeyILTRIQUCENKCOZ-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.30
Rot. Bonds7

About 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol

1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol (PubChem CID 104659510) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol
PubChem CID104659510
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol
SMILESCOCCOc1ccccc1C(O)Cc1cccc(C)c1
InChIInChI=1S/C18H22O3/c1-14-6-5-7-15(12-14)13-17(19)16-8-3-4-9-18(16)21-11-10-20-2/h3-9,12,17,19H,10-11,13H2,1-2H3
InChIKeyILTRIQUCENKCOZ-UHFFFAOYSA-N
XLogP3.30
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(3-methylphenyl)-1-(2-propoxyphenyl)ethanol
CID 104659511
1-[2-(2-methoxyethoxy)phenyl]-2-phenylethanol
CID 104658697
1-[2-(difluoromethoxy)phenyl]-2-(3-methylphenyl)ethanol
CID 63017552
2-amino-1-[2-(2-methoxyethoxy)phenyl]ethanol
CID 102533880
3-amino-1-[2-(2-methoxyethoxy)phenyl]propan-1-ol
CID 104658969
[2-(3-methylphenyl)-1-(2-propoxyphenyl)ethyl]hydrazine
CID 105208882
4-methoxy-1-[2-(2-methoxyethoxy)phenyl]pentan-1-ol
CID 105125505
3-[2-(2-methoxyethoxy)phenyl]butan-2-ol
CID 104662429
[2-(2-methoxyethoxy)phenyl]-(2-methylfuran-3-yl)methanol
CID 104789530
1-(2-bromo-4,5-dimethoxyphenyl)-2-(3-methylphenyl)ethanol
CID 62389072
[2-(2-methoxyethoxy)phenyl]-(4-methyl-2-pyridinyl)methanamine
CID 104660123
2,2-dimethoxy-1-[2-(2-methoxyethoxy)phenyl]ethanol
CID 104658798

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol?
The IUPAC name of 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol (CID 104659510) is 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol?
The canonical SMILES for 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol is COCCOc1ccccc1C(O)Cc1cccc(C)c1.
What is the InChIKey of 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol?
The InChIKey is ILTRIQUCENKCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-14-6-5-7-15(12-14)13-17(19)16-8-3-4-9-18(16)21-11-10-20-2/h3-9,12,17,19H,10-11,13H2,1-2H3.
What are the key properties of 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol?
1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol has a molecular weight of 286.37 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)phenyl]-2-(3-methylphenyl)ethanol is sourced from PubChem (CID 104659510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).