3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol

C16H17FO2 — CID 66059844

IUPAC3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol
SMILESCOc1ccc(CC(CO)c2ccccc2)cc1F
InChIInChI=1S/C16H17FO2/c1-19-16-8-7-12(10-15(16)17)9-14(11-18)13-5-3-2-4-6-13/h2-8,10,14,18H,9,11H2,1H3
InChIKeyGHFBJEPLCZVZMN-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.15
Rot. Bonds5

About 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol

3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol (PubChem CID 66059844) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol
PubChem CID66059844
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol
SMILESCOc1ccc(CC(CO)c2ccccc2)cc1F
InChIInChI=1S/C16H17FO2/c1-19-16-8-7-12(10-15(16)17)9-14(11-18)13-5-3-2-4-6-13/h2-8,10,14,18H,9,11H2,1H3
InChIKeyGHFBJEPLCZVZMN-UHFFFAOYSA-N
XLogP3.15
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-chloro-2-phenylpropyl)-2-fluoro-1-methoxybenzene
CID 66033669
4-[3-bromo-2-(4-bromophenyl)propyl]-2-fluoro-1-methoxybenzene
CID 79434131
2-[(3-fluoro-4-methoxyphenyl)methyl]-3-(2-methylphenyl)propan-1-ol
CID 66059093
3-(3-bromo-4-methoxyphenyl)-2-(2-fluorophenyl)propan-1-ol
CID 79449548
3-(5-bromo-2-methoxyphenyl)-2-phenylpropan-1-ol
CID 66060063
(1R)-N-[(3-fluoro-4-methoxyphenyl)methyl]-1-phenylethanamine
CID 55257635
3-(3-fluoro-4-methoxyphenyl)-1-methoxy-1-phenylpropan-2-one
CID 116751347
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)ethanol
CID 62622685
2-(3-fluoro-4-methoxyphenyl)-1-(2-iodophenyl)ethanol
CID 115782342
1-(3-fluoro-4-methoxyphenyl)-3-(2-hydroxy-1-phenylethyl)urea
CID 110895751
2-(3-fluoro-4-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
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CID 62608783

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol?
The IUPAC name of 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol (CID 66059844) is 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol.
What is the SMILES notation for 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol?
The canonical SMILES for 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol is COc1ccc(CC(CO)c2ccccc2)cc1F.
What is the InChIKey of 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol?
The InChIKey is GHFBJEPLCZVZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-19-16-8-7-12(10-15(16)17)9-14(11-18)13-5-3-2-4-6-13/h2-8,10,14,18H,9,11H2,1H3.
What are the key properties of 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol?
3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol has a molecular weight of 260.31 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-4-methoxyphenyl)-2-phenylpropan-1-ol is sourced from PubChem (CID 66059844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).