3-(5-fluoro-2-methylphenoxy)oxane

C12H15FO2 — CID 107137933

IUPAC3-(5-fluoro-2-methylphenoxy)oxane
SMILESCc1ccc(F)cc1OC1CCCOC1
InChIInChI=1S/C12H15FO2/c1-9-4-5-10(13)7-12(9)15-11-3-2-6-14-8-11/h4-5,7,11H,2-3,6,8H2,1H3
InChIKeyUDPHGVJAAZBCPS-UHFFFAOYSA-N
MW210.25 g/mol
LogP2.69
Rot. Bonds2

About 3-(5-fluoro-2-methylphenoxy)oxane

3-(5-fluoro-2-methylphenoxy)oxane (PubChem CID 107137933) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is 3-(5-fluoro-2-methylphenoxy)oxane.

Molecular Properties

Compound Name3-(5-fluoro-2-methylphenoxy)oxane
PubChem CID107137933
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Name3-(5-fluoro-2-methylphenoxy)oxane
SMILESCc1ccc(F)cc1OC1CCCOC1
InChIInChI=1S/C12H15FO2/c1-9-4-5-10(13)7-12(9)15-11-3-2-6-14-8-11/h4-5,7,11H,2-3,6,8H2,1H3
InChIKeyUDPHGVJAAZBCPS-UHFFFAOYSA-N
XLogP2.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(5-fluoro-2-methylphenoxy)oxane 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

2-cyclohexyloxy-4-fluoro-1-methylbenzene
CID 102990540
8-(5-fluoro-2-methylphenoxy)-5-oxaspiro[3.5]nonane
CID 102990531
1-[5-fluoro-2-(oxan-3-yloxy)phenyl]-N-methylmethanamine
CID 107695044
N'-hydroxy-4-methyl-3-(oxan-3-yloxy)benzenecarboximidamide
CID 107656852
4-fluoro-2-[(1R,3S)-3-methoxycyclohexyl]oxy-1-methylbenzene
CID 90221775
3-(4-fluoro-3-methylphenoxy)oxane
CID 107137923
4-fluoro-2-(4-methoxycyclohexyl)oxy-1-methylbenzene
CID 90140548
trifluoro-[3-methyl-4-(oxan-3-yloxy)phenyl]boranuide
CID 107135258
(3S)-3-(2-bromo-5-fluorophenoxy)oxolane
CID 118590561
2-methyl-3-(oxan-3-yloxy)phenol
CID 107135241
3-(5-fluoro-2-methylphenoxy)azetidine
CID 84657893
(1R)-1-[4-fluoro-2-(oxolan-3-yloxy)phenyl]ethanol
CID 63557560

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-2-methylphenoxy)oxane?
The IUPAC name of 3-(5-fluoro-2-methylphenoxy)oxane (CID 107137933) is 3-(5-fluoro-2-methylphenoxy)oxane.
What is the SMILES notation for 3-(5-fluoro-2-methylphenoxy)oxane?
The canonical SMILES for 3-(5-fluoro-2-methylphenoxy)oxane is Cc1ccc(F)cc1OC1CCCOC1.
What is the InChIKey of 3-(5-fluoro-2-methylphenoxy)oxane?
The InChIKey is UDPHGVJAAZBCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO2/c1-9-4-5-10(13)7-12(9)15-11-3-2-6-14-8-11/h4-5,7,11H,2-3,6,8H2,1H3.
What are the key properties of 3-(5-fluoro-2-methylphenoxy)oxane?
3-(5-fluoro-2-methylphenoxy)oxane has a molecular weight of 210.25 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-2-methylphenoxy)oxane is sourced from PubChem (CID 107137933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).