1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol

C17H19FO3 — CID 62865520

IUPAC1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol
SMILESCOc1cc(F)c(C(O)Cc2ccc(C)cc2)cc1OC
InChIInChI=1S/C17H19FO3/c1-11-4-6-12(7-5-11)8-15(19)13-9-16(20-2)17(21-3)10-14(13)18/h4-7,9-10,15,19H,8H2,1-3H3
InChIKeyRJIPVTPOFWFWSU-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.43
Rot. Bonds5

About 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol

1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol (PubChem CID 62865520) has the molecular formula C17H19FO3 and a molecular weight of 290.33 g/mol. Its IUPAC name is 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol
PubChem CID62865520
Molecular FormulaC17H19FO3
Molecular Weight290.33 g/mol
Exact Mass290.13
IUPAC Name1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol
SMILESCOc1cc(F)c(C(O)Cc2ccc(C)cc2)cc1OC
InChIInChI=1S/C17H19FO3/c1-11-4-6-12(7-5-11)8-15(19)13-9-16(20-2)17(21-3)10-14(13)18/h4-7,9-10,15,19H,8H2,1-3H3
InChIKeyRJIPVTPOFWFWSU-UHFFFAOYSA-N
XLogP3.43
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
1-(2,5-difluorophenyl)-2-(4-methylphenyl)ethanol
CID 61099597
1-(4-chloro-2-fluorophenyl)-2-(4-methylphenyl)ethanol
CID 63016785
2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 61081695
1-(2-bromo-4,5-dimethoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 61087578
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(4-bromophenyl)ethanol
CID 103395965
2-(3-bromo-4-methoxyphenyl)-1-(2,4-difluoro-5-methylphenyl)ethanol
CID 115779414
2-(4-methylphenyl)-1-(2,4,5-trimethylphenyl)ethanol
CID 64990344
1-[1-chloro-2-(4-methylphenyl)ethyl]-4,5-dimethoxy-2-methylbenzene
CID 63435129
1-(2-fluoro-4,5-dimethoxyphenyl)heptan-1-ol
CID 114753416
1-(2,5-dimethylfuran-3-yl)-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 115782163
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(3-methylphenyl)ethanol
CID 103396109

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol?
The IUPAC name of 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol (CID 62865520) is 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol.
What is the SMILES notation for 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol?
The canonical SMILES for 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol is COc1cc(F)c(C(O)Cc2ccc(C)cc2)cc1OC.
What is the InChIKey of 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol?
The InChIKey is RJIPVTPOFWFWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO3/c1-11-4-6-12(7-5-11)8-15(19)13-9-16(20-2)17(21-3)10-14(13)18/h4-7,9-10,15,19H,8H2,1-3H3.
What are the key properties of 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol?
1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol has a molecular weight of 290.33 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4,5-dimethoxyphenyl)-2-(4-methylphenyl)ethanol is sourced from PubChem (CID 62865520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).