3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol

C12H15FO2 — CID 66368118

IUPAC3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1Oc1cccc(F)c1
InChIInChI=1S/C12H15FO2/c1-12(2)10(14)7-11(12)15-9-5-3-4-8(13)6-9/h3-6,10-11,14H,7H2,1-2H3
InChIKeyZTXDPBMCIUODEH-UHFFFAOYSA-N
MW210.25 g/mol
LogP2.36
Rot. Bonds2

About 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol

3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol (PubChem CID 66368118) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol
PubChem CID66368118
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Name3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1Oc1cccc(F)c1
InChIInChI=1S/C12H15FO2/c1-12(2)10(14)7-11(12)15-9-5-3-4-8(13)6-9/h3-6,10-11,14H,7H2,1-2H3
InChIKeyZTXDPBMCIUODEH-UHFFFAOYSA-N
XLogP2.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-difluorophenoxy)-2,2-dimethylcyclobutan-1-ol
CID 66345004
3-[3-(methoxymethyl)phenoxy]-2,2-dimethylcyclobutan-1-ol
CID 66343338
2,2-dimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol
CID 66346470
2-ethyl-3-(3-fluorophenoxy)-N,2-dimethylcyclobutan-1-amine
CID 66357331
1-fluoro-3-(3-methylcyclobutyl)oxybenzene
CID 142422559
3-(3-fluorophenoxy)-N-methylspiro[3.6]decan-1-amine
CID 66357529
3-(2-fluoro-6-nitrophenoxy)-2,2-dimethylcyclobutan-1-ol
CID 104832503
trans-(1R,2R)-2-(3-fluorophenoxy)cyclohexan-1-ol
CID 102732532
2-amino-1-[(3R,4R)-3-(3-fluorophenoxy)-4-hydroxy-4-methylpiperidin-1-yl]ethanone
CID 110146277
3-bromo-1-(3-fluorophenoxy)spiro[3.5]nonane
CID 66345275
3-(2,3-dichlorophenoxy)-2,2-dimethylcyclobutan-1-ol
CID 66367122
N-ethyl-3-(3-fluorophenoxy)spiro[3.6]decan-1-amine
CID 66357329

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol (CID 66368118) is 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol is CC1(C)C(O)CC1Oc1cccc(F)c1.
What is the InChIKey of 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol?
The InChIKey is ZTXDPBMCIUODEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO2/c1-12(2)10(14)7-11(12)15-9-5-3-4-8(13)6-9/h3-6,10-11,14H,7H2,1-2H3.
What are the key properties of 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol?
3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol has a molecular weight of 210.25 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenoxy)-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 66368118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).