2-[(3-fluorophenyl)methoxy]oxane

C12H15FO2 — CID 22446153

IUPAC2-[(3-fluorophenyl)methoxy]oxane
SMILESFc1cccc(COC2CCCCO2)c1
InChIInChI=1S/C12H15FO2/c13-11-5-3-4-10(8-11)9-15-12-6-1-2-7-14-12/h3-5,8,12H,1-2,6-7,9H2
InChIKeyVHFIVTIVNMXWPC-UHFFFAOYSA-N
MW210.25 g/mol
LogP2.87
Rot. Bonds3

About 2-[(3-fluorophenyl)methoxy]oxane

2-[(3-fluorophenyl)methoxy]oxane (PubChem CID 22446153) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methoxy]oxane.

Molecular Properties

Compound Name2-[(3-fluorophenyl)methoxy]oxane
PubChem CID22446153
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Name2-[(3-fluorophenyl)methoxy]oxane
SMILESFc1cccc(COC2CCCCO2)c1
InChIInChI=1S/C12H15FO2/c13-11-5-3-4-10(8-11)9-15-12-6-1-2-7-14-12/h3-5,8,12H,1-2,6-7,9H2
InChIKeyVHFIVTIVNMXWPC-UHFFFAOYSA-N
XLogP2.87
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-bis[3-(oxan-2-yloxymethyl)phenyl]propan-2-one
CID 146792534
3-(oxan-2-yloxymethyl)benzamide
CID 139882771
2-[(3-nitrophenyl)methoxy]oxane
CID 10955574
2-[[3-[[2-[[2-[(2-benzylphenyl)methyl]phenyl]methyl]phenyl]methyl]phenyl]methoxy]oxane
CID 10392867
2-[[3-(bromomethyl)-4-fluorophenyl]methoxy]oxane
CID 67128227
3-(oxan-2-yloxymethyl)-N-[4-[[4-[3-(oxan-2-yloxymethyl)-N-[3-(oxan-2-yloxymethyl)phenyl]anilino]phenyl]methyl]phenyl]-N-[3-(oxan-2-yloxymethyl)phenyl]aniline
CID 90246762
bicyclo[2.2.1]hepta-1,3,5-triene;2-[(3-methylphenyl)methoxy]oxane
CID 174264663
2-[(3-fluorophenyl)methoxymethyl]oxolane
CID 91656930
(2S)-2-[(4-bromophenyl)methoxy]oxane
CID 68903974
2-chloro-4-(oxan-2-yloxymethyl)pyridine
CID 86090104
2-[4-(oxan-2-yloxymethyl)phenoxy]oxane
CID 101362561
2-[(3-fluorophenyl)methoxy]cycloheptan-1-amine
CID 113395242

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenyl)methoxy]oxane?
The IUPAC name of 2-[(3-fluorophenyl)methoxy]oxane (CID 22446153) is 2-[(3-fluorophenyl)methoxy]oxane.
What is the SMILES notation for 2-[(3-fluorophenyl)methoxy]oxane?
The canonical SMILES for 2-[(3-fluorophenyl)methoxy]oxane is Fc1cccc(COC2CCCCO2)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methoxy]oxane?
The InChIKey is VHFIVTIVNMXWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO2/c13-11-5-3-4-10(8-11)9-15-12-6-1-2-7-14-12/h3-5,8,12H,1-2,6-7,9H2.
What are the key properties of 2-[(3-fluorophenyl)methoxy]oxane?
2-[(3-fluorophenyl)methoxy]oxane has a molecular weight of 210.25 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methoxy]oxane is sourced from PubChem (CID 22446153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).