1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol

C16H17FO2 — CID 82090144

IUPAC1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol
SMILESCc1cc(C(C)O)ccc1OCc1ccc(F)cc1
InChIInChI=1S/C16H17FO2/c1-11-9-14(12(2)18)5-8-16(11)19-10-13-3-6-15(17)7-4-13/h3-9,12,18H,10H2,1-2H3
InChIKeyGMKHLYZLNUQTSJ-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.77
Rot. Bonds4

About 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol

1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol (PubChem CID 82090144) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol.

Molecular Properties

Compound Name1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol
PubChem CID82090144
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol
SMILESCc1cc(C(C)O)ccc1OCc1ccc(F)cc1
InChIInChI=1S/C16H17FO2/c1-11-9-14(12(2)18)5-8-16(11)19-10-13-3-6-15(17)7-4-13/h3-9,12,18H,10H2,1-2H3
InChIKeyGMKHLYZLNUQTSJ-UHFFFAOYSA-N
XLogP3.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-methyl-4-[(4-methylphenyl)methoxy]phenyl]ethanol
CID 82089007
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
ethane;1-[(4-fluorophenyl)methoxy]-2-methyl-4-(trifluoromethyl)benzene
CID 143034150
1-(3-fluoro-4-phenylmethoxyphenyl)ethanol
CID 115582207
1-[3-fluoro-4-[(4-methoxyphenyl)methoxy]phenyl]ethanol
CID 115582214
2-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]acetic acid
CID 82051629
(1R)-1-[4-[(3-chloro-2-fluorophenyl)methoxy]-3-methylphenyl]ethanol
CID 102856322
[4-[(2-methyl-4-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 169301996
(1R)-1-[4-[(5-fluoro-2-methylphenyl)methoxy]-3-methoxyphenyl]ethanol
CID 105372092
1-[(4-fluorophenyl)methoxy]-2-methoxy-4-propan-2-ylbenzene
CID 130325597
(1S)-1-[4-fluoro-2-[(4-methylphenyl)methoxy]phenyl]ethanol
CID 78932617
(1S)-1-[4-[(4-chloro-3-fluorophenyl)methoxy]-3-fluorophenyl]ethanol
CID 107882473

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol?
The IUPAC name of 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol (CID 82090144) is 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol.
What is the SMILES notation for 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol?
The canonical SMILES for 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol is Cc1cc(C(C)O)ccc1OCc1ccc(F)cc1.
What is the InChIKey of 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol?
The InChIKey is GMKHLYZLNUQTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-9-14(12(2)18)5-8-16(11)19-10-13-3-6-15(17)7-4-13/h3-9,12,18H,10H2,1-2H3.
What are the key properties of 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol?
1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-fluorophenyl)methoxy]-3-methylphenyl]ethanol is sourced from PubChem (CID 82090144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).