1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone

C15H13FO2 — CID 2758968

IUPAC1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone
SMILESCC(=O)c1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C15H13FO2/c1-11(17)13-5-7-15(8-6-13)18-10-12-3-2-4-14(16)9-12/h2-9H,10H2,1H3
InChIKeyMZKVEEAJHDPMIG-UHFFFAOYSA-N
MW244.27 g/mol
LogP3.61
Rot. Bonds4

About 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone

1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone (PubChem CID 2758968) has the molecular formula C15H13FO2 and a molecular weight of 244.27 g/mol. Its IUPAC name is 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone
PubChem CID2758968
Molecular FormulaC15H13FO2
Molecular Weight244.27 g/mol
Exact Mass244.09
IUPAC Name1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone
SMILESCC(=O)c1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C15H13FO2/c1-11(17)13-5-7-15(8-6-13)18-10-12-3-2-4-14(16)9-12/h2-9H,10H2,1H3
InChIKeyMZKVEEAJHDPMIG-UHFFFAOYSA-N
XLogP3.61
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone?
The IUPAC name of 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone (CID 2758968) is 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone.
What is the SMILES notation for 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone?
The canonical SMILES for 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone is CC(=O)c1ccc(OCc2cccc(F)c2)cc1.
What is the InChIKey of 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone?
The InChIKey is MZKVEEAJHDPMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO2/c1-11(17)13-5-7-15(8-6-13)18-10-12-3-2-4-14(16)9-12/h2-9H,10H2,1H3.
What are the key properties of 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone?
1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone has a molecular weight of 244.27 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3-fluorophenyl)methoxy]phenyl]ethanone is sourced from PubChem (CID 2758968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).