5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one

C17H15FO3 — CID 25178576

IUPAC5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one
SMILESO=C1CCC(c2ccc(OCc3ccc(F)cc3)cc2)O1
InChIInChI=1S/C17H15FO3/c18-14-5-1-12(2-6-14)11-20-15-7-3-13(4-8-15)16-9-10-17(19)21-16/h1-8,16H,9-11H2
InChIKeyMAPCELMSESYGIG-UHFFFAOYSA-N
MW286.30 g/mol
LogP3.78
Rot. Bonds4

About 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one

5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one (PubChem CID 25178576) has the molecular formula C17H15FO3 and a molecular weight of 286.30 g/mol. Its IUPAC name is 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one.

Molecular Properties

Compound Name5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one
PubChem CID25178576
Molecular FormulaC17H15FO3
Molecular Weight286.30 g/mol
Exact Mass286.10
IUPAC Name5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one
SMILESO=C1CCC(c2ccc(OCc3ccc(F)cc3)cc2)O1
InChIInChI=1S/C17H15FO3/c18-14-5-1-12(2-6-14)11-20-15-7-3-13(4-8-15)16-9-10-17(19)21-16/h1-8,16H,9-11H2
InChIKeyMAPCELMSESYGIG-UHFFFAOYSA-N
XLogP3.78
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one 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

5-[4-[(2-fluorophenyl)methoxy]phenyl]oxolan-2-one
CID 25178378
5-[4-[(2-bromophenyl)methoxy]phenyl]oxolan-2-one
CID 25180882
(6S)-6-(4-fluorophenyl)oxan-2-one
CID 56598080
(5S)-5-(4-methoxyphenyl)oxolan-2-one
CID 12862881
(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one
CID 97228892
N-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]cyclopropanamine
CID 62454139
9-[4-[(4-fluorophenyl)methoxy]phenyl]-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione
CID 5104099
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
(2R)-6-phenylmethoxy-2-(4-phenylmethoxyphenyl)-3,4-dihydro-2H-chromene
CID 142956928
5-phenyloxolan-2-one
CID 13884
ethane;1-[2-[4-[(4-fluorophenyl)methoxy]phenyl]cyclopropyl]ethanone
CID 145400535
1-(chloromethyl)-4-[(4-fluorophenyl)methoxy]benzene
CID 22280023

Frequently Asked Questions

What is the IUPAC name of 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one?
The IUPAC name of 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one (CID 25178576) is 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one.
What is the SMILES notation for 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one?
The canonical SMILES for 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one is O=C1CCC(c2ccc(OCc3ccc(F)cc3)cc2)O1.
What is the InChIKey of 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one?
The InChIKey is MAPCELMSESYGIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FO3/c18-14-5-1-12(2-6-14)11-20-15-7-3-13(4-8-15)16-9-10-17(19)21-16/h1-8,16H,9-11H2.
What are the key properties of 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one?
5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one has a molecular weight of 286.30 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[(4-fluorophenyl)methoxy]phenyl]oxolan-2-one is sourced from PubChem (CID 25178576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).