2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol

C17H19FO2 — CID 61087614

IUPAC2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccc(C(O)Cc2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FO2/c1-12(2)20-16-9-5-14(6-10-16)17(19)11-13-3-7-15(18)8-4-13/h3-10,12,17,19H,11H2,1-2H3
InChIKeyYMDPKARRVMAYND-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.89
Rot. Bonds5

About 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol

2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol (PubChem CID 61087614) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol
PubChem CID61087614
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol
SMILESCC(C)Oc1ccc(C(O)Cc2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FO2/c1-12(2)20-16-9-5-14(6-10-16)17(19)11-13-3-7-15(18)8-4-13/h3-10,12,17,19H,11H2,1-2H3
InChIKeyYMDPKARRVMAYND-UHFFFAOYSA-N
XLogP3.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-butoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 63017882
2-(4-fluorophenyl)-1-(4-phenoxyphenyl)ethanol
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(1R)-2-(4-fluorophenyl)-1-phenylethanol
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N-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-propan-2-yloxybenzenesulfonamide
CID 110665841
2-[(3-fluorophenyl)methylamino]-1-(4-propan-2-yloxyphenyl)ethanol
CID 111422221
3-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]-3-(4-propan-2-yloxyphenyl)propan-1-amine
CID 5032799
2-(2-methyl-1,3-thiazol-4-yl)-1-(4-propan-2-yloxyphenyl)ethanol
CID 62799330
1-(4-fluorophenyl)-2-pyridin-4-ylethanol
CID 62553094
1-(4-fluorophenyl)-2-propan-2-yloxyethanol
CID 79567387

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol?
The IUPAC name of 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol (CID 61087614) is 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol?
The canonical SMILES for 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol is CC(C)Oc1ccc(C(O)Cc2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol?
The InChIKey is YMDPKARRVMAYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-12(2)20-16-9-5-14(6-10-16)17(19)11-13-3-7-15(18)8-4-13/h3-10,12,17,19H,11H2,1-2H3.
What are the key properties of 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol?
2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol has a molecular weight of 274.34 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(4-propan-2-yloxyphenyl)ethanol is sourced from PubChem (CID 61087614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).