2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol

C17H19FO2 — CID 63935953

IUPAC2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol
SMILESCc1ccc(C(O)C(C)OCc2ccccc2F)cc1
InChIInChI=1S/C17H19FO2/c1-12-7-9-14(10-8-12)17(19)13(2)20-11-15-5-3-4-6-16(15)18/h3-10,13,17,19H,11H2,1-2H3
InChIKeyAVXHCJZQIYDOBL-UHFFFAOYSA-N
MW274.33 g/mol
LogP3.77
Rot. Bonds5

About 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol

2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol (PubChem CID 63935953) has the molecular formula C17H19FO2 and a molecular weight of 274.33 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol
PubChem CID63935953
Molecular FormulaC17H19FO2
Molecular Weight274.33 g/mol
Exact Mass274.14
IUPAC Name2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol
SMILESCc1ccc(C(O)C(C)OCc2ccccc2F)cc1
InChIInChI=1S/C17H19FO2/c1-12-7-9-14(10-8-12)17(19)13(2)20-11-15-5-3-4-6-16(15)18/h3-10,13,17,19H,11H2,1-2H3
InChIKeyAVXHCJZQIYDOBL-UHFFFAOYSA-N
XLogP3.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-fluorophenyl)methoxy]-N-methylbutan-2-amine
CID 63935715
2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine
CID 63936123
2-(3,3-dimethylbutoxy)-1-(4-methylphenyl)propan-1-ol
CID 66224938
(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 78934333
2-(2,5-difluorophenoxy)-1-(4-methylphenyl)propan-1-ol
CID 63269926
1-(4-chlorobutan-2-yloxymethyl)-2-fluorobenzene
CID 134202097
1-fluoro-2-[(4-propan-2-ylphenoxy)methyl]benzene
CID 60627565
N-[2-(2-fluorophenyl)ethyl]-1-(4-methylphenyl)ethanamine
CID 43095856
2-(cyclopentylmethoxy)-1-(4-methylphenyl)propan-1-ol
CID 66322023
methyl 3-[4-[(2-fluorophenyl)methoxy]phenyl]-2,3-dihydroxypropanoate
CID 171865239
2-(2-fluorophenyl)sulfonyl-1-(4-methylphenyl)propan-1-ol
CID 106585237
2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol
CID 62383408

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol (CID 63935953) is 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol is Cc1ccc(C(O)C(C)OCc2ccccc2F)cc1.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol?
The InChIKey is AVXHCJZQIYDOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-12-7-9-14(10-8-12)17(19)13(2)20-11-15-5-3-4-6-16(15)18/h3-10,13,17,19H,11H2,1-2H3.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol?
2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol has a molecular weight of 274.33 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol is sourced from PubChem (CID 63935953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).