1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol

C17H19FO3 — CID 65101453

IUPAC1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2cc(C)ccc2OC)cc1F
InChIInChI=1S/C17H19FO3/c1-11-4-6-16(20-2)13(8-11)10-15(19)12-5-7-17(21-3)14(18)9-12/h4-9,15,19H,10H2,1-3H3
InChIKeyMKNJTJRDBLQSCQ-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.43
Rot. Bonds5

About 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol

1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 65101453) has the molecular formula C17H19FO3 and a molecular weight of 290.33 g/mol. Its IUPAC name is 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
PubChem CID65101453
Molecular FormulaC17H19FO3
Molecular Weight290.33 g/mol
Exact Mass290.13
IUPAC Name1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2cc(C)ccc2OC)cc1F
InChIInChI=1S/C17H19FO3/c1-11-4-6-16(20-2)13(8-11)10-15(19)12-5-7-17(21-3)14(18)9-12/h4-9,15,19H,10H2,1-3H3
InChIKeyMKNJTJRDBLQSCQ-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-(4-fluoro-3-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 62160340
1-(2,6-difluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 63895079
2-(2,4-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 62796974
2-(2-methoxy-5-methylphenyl)-1-(6-methyl-3-pyridinyl)ethanol
CID 104822975
1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
2-(2-chloro-4-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 63035615
2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 63018668
1-(furan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 63895146
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 107307527
2-amino-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 13079645
(1R)-2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 83000611
1-(3,4-difluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 61089068

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol (CID 65101453) is 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol is COc1ccc(C(O)Cc2cc(C)ccc2OC)cc1F.
What is the InChIKey of 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is MKNJTJRDBLQSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO3/c1-11-4-6-16(20-2)13(8-11)10-15(19)12-5-7-17(21-3)14(18)9-12/h4-9,15,19H,10H2,1-3H3.
What are the key properties of 1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol?
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-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-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 65101453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).