2-(3-fluorophenyl)-2-phenylpropanoic acid

C15H13FO2 — CID 18931684

IUPAC2-(3-fluorophenyl)-2-phenylpropanoic acid
SMILESCC(C(=O)O)(c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C15H13FO2/c1-15(14(17)18,11-6-3-2-4-7-11)12-8-5-9-13(16)10-12/h2-10H,1H3,(H,17,18)
InChIKeyGEMNINBVEYOFQF-UHFFFAOYSA-N
MW244.27 g/mol
LogP3.22
Rot. Bonds3

About 2-(3-fluorophenyl)-2-phenylpropanoic acid

2-(3-fluorophenyl)-2-phenylpropanoic acid (PubChem CID 18931684) has the molecular formula C15H13FO2 and a molecular weight of 244.27 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-phenylpropanoic acid.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-phenylpropanoic acid
PubChem CID18931684
Molecular FormulaC15H13FO2
Molecular Weight244.27 g/mol
Exact Mass244.09
IUPAC Name2-(3-fluorophenyl)-2-phenylpropanoic acid
SMILESCC(C(=O)O)(c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C15H13FO2/c1-15(14(17)18,11-6-3-2-4-7-11)12-8-5-9-13(16)10-12/h2-10H,1H3,(H,17,18)
InChIKeyGEMNINBVEYOFQF-UHFFFAOYSA-N
XLogP3.22
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-2-(3-fluorophenyl)propanoic acid
CID 67757500
(2S)-2-(3-fluorophenyl)-2-(methylamino)propanoic acid
CID 93279972
2-anilino-2-(3-fluorophenyl)propanoic acid
CID 60991500
2-cyclopropyl-2-(3-fluorophenyl)propanoic acid
CID 83834060
2-amino-2-(3-fluorophenyl)-2-phenylacetic acid;hydrochloride
CID 174636753
2-(3-fluorophenyl)-2-formamidopropanoic acid
CID 63687632
2-(3-fluorophenyl)-2-hydroxypropanamide
CID 62213418
(2R)-2-amino-2-(3-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid
CID 138393513
2-(3-fluorophenyl)-2-phenylbutanedioic acid
CID 152760459
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
2-[3-fluoro-4-(methanesulfonamido)phenyl]-2-phenylpropanoic acid
CID 174593409
N-[2-(3-fluorophenyl)propan-2-yl]-2-phenylacetamide
CID 12790289

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-phenylpropanoic acid?
The IUPAC name of 2-(3-fluorophenyl)-2-phenylpropanoic acid (CID 18931684) is 2-(3-fluorophenyl)-2-phenylpropanoic acid.
What is the SMILES notation for 2-(3-fluorophenyl)-2-phenylpropanoic acid?
The canonical SMILES for 2-(3-fluorophenyl)-2-phenylpropanoic acid is CC(C(=O)O)(c1ccccc1)c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-2-phenylpropanoic acid?
The InChIKey is GEMNINBVEYOFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO2/c1-15(14(17)18,11-6-3-2-4-7-11)12-8-5-9-13(16)10-12/h2-10H,1H3,(H,17,18).
What are the key properties of 2-(3-fluorophenyl)-2-phenylpropanoic acid?
2-(3-fluorophenyl)-2-phenylpropanoic acid has a molecular weight of 244.27 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-phenylpropanoic acid is sourced from PubChem (CID 18931684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).