2-(3-phenoxyphenyl)propanoic acid

C15H14O3 — CID 3342

💊View drug profile → fenoprofen
IUPAC2-(3-phenoxyphenyl)propanoic acid
SMILESCC(C(=O)O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17)
InChIKeyRDJGLLICXDHJDY-UHFFFAOYSA-N
MW242.27 g/mol
LogP3.67
Rot. Bonds4

About 2-(3-phenoxyphenyl)propanoic acid

2-(3-phenoxyphenyl)propanoic acid (PubChem CID 3342) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-(3-phenoxyphenyl)propanoic acid.

Molecular Properties

Compound Name2-(3-phenoxyphenyl)propanoic acid
PubChem CID3342
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name2-(3-phenoxyphenyl)propanoic acid
SMILESCC(C(=O)O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17)
InChIKeyRDJGLLICXDHJDY-UHFFFAOYSA-N
XLogP3.67
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Phenoxybenzoic acid
CID 19539
Fenoprofen Calcium
CID 64747
p-CRESYL PHENYLACETATE
CID 60997
4-Phenoxybenzoic acid
CID 75182
(3-Methoxyphenyl)acetic acid
CID 15719
2,5-Dimethoxyphenylacetic acid
CID 74469
Phenylparaben
CID 87250
3-Tolyl phenylacetate
CID 67146
4-(Benzyloxy)benzoic acid
CID 73880
Xanthene-9-carboxylic acid
CID 65736
Cresentyl
CID 69193
3-(m-Methoxyphenyl)propionic acid
CID 66336

Frequently Asked Questions

What is the IUPAC name of 2-(3-phenoxyphenyl)propanoic acid?
The IUPAC name of 2-(3-phenoxyphenyl)propanoic acid (CID 3342) is 2-(3-phenoxyphenyl)propanoic acid.
What is the SMILES notation for 2-(3-phenoxyphenyl)propanoic acid?
The canonical SMILES for 2-(3-phenoxyphenyl)propanoic acid is CC(C(=O)O)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of 2-(3-phenoxyphenyl)propanoic acid?
The InChIKey is RDJGLLICXDHJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17).
What are the key properties of 2-(3-phenoxyphenyl)propanoic acid?
2-(3-phenoxyphenyl)propanoic acid has a molecular weight of 242.27 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenoxyphenyl)propanoic acid is sourced from PubChem (CID 3342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).