2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol

C17H19FO — CID 134432733

IUPAC2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
SMILESCCCc1ccc(-c2ccc(CCO)cc2)c(F)c1
InChIInChI=1S/C17H19FO/c1-2-3-14-6-9-16(17(18)12-14)15-7-4-13(5-8-15)10-11-19/h4-9,12,19H,2-3,10-11H2,1H3
InChIKeyIFONRWMELZDQMU-UHFFFAOYSA-N
MW258.34 g/mol
LogP3.98
Rot. Bonds5

About 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol

2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol (PubChem CID 134432733) has the molecular formula C17H19FO and a molecular weight of 258.34 g/mol. Its IUPAC name is 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
PubChem CID134432733
Molecular FormulaC17H19FO
Molecular Weight258.34 g/mol
Exact Mass258.14
IUPAC Name2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
SMILESCCCc1ccc(-c2ccc(CCO)cc2)c(F)c1
InChIInChI=1S/C17H19FO/c1-2-3-14-6-9-16(17(18)12-14)15-7-4-13(5-8-15)10-11-19/h4-9,12,19H,2-3,10-11H2,1H3
InChIKeyIFONRWMELZDQMU-UHFFFAOYSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol?
The IUPAC name of 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol (CID 134432733) is 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol.
What is the SMILES notation for 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol?
The canonical SMILES for 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol is CCCc1ccc(-c2ccc(CCO)cc2)c(F)c1.
What is the InChIKey of 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol?
The InChIKey is IFONRWMELZDQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO/c1-2-3-14-6-9-16(17(18)12-14)15-7-4-13(5-8-15)10-11-19/h4-9,12,19H,2-3,10-11H2,1H3.
What are the key properties of 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol?
2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol has a molecular weight of 258.34 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol is sourced from PubChem (CID 134432733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).