1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol

C11H12F2O — CID 103564462

IUPAC1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol
SMILESCC1CC(O)(c2cc(F)ccc2F)C1
InChIInChI=1S/C11H12F2O/c1-7-5-11(14,6-7)9-4-8(12)2-3-10(9)13/h2-4,7,14H,5-6H2,1H3
InChIKeyUIUJCSDFMQNJDP-UHFFFAOYSA-N
MW198.21 g/mol
LogP2.58
Rot. Bonds1

About 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol

1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol (PubChem CID 103564462) has the molecular formula C11H12F2O and a molecular weight of 198.21 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol
PubChem CID103564462
Molecular FormulaC11H12F2O
Molecular Weight198.21 g/mol
Exact Mass198.09
IUPAC Name1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol
SMILESCC1CC(O)(c2cc(F)ccc2F)C1
InChIInChI=1S/C11H12F2O/c1-7-5-11(14,6-7)9-4-8(12)2-3-10(9)13/h2-4,7,14H,5-6H2,1H3
InChIKeyUIUJCSDFMQNJDP-UHFFFAOYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.21
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,5-difluorophenyl)-1-methylpiperidin-4-ol
CID 12694024
1-(2,5-difluorophenyl)-5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 63409046
1-(5-fluoro-2-methylphenyl)-3-methylcyclohexan-1-ol
CID 62788300
1-(4-fluoro-3-methylphenyl)-3-methylcyclobutan-1-ol
CID 103564406
1-(2,5-difluorophenyl)-3-methylcyclopentan-1-amine
CID 64515768
4-tert-butyl-1-(2,5-difluorophenyl)cycloheptan-1-ol
CID 65094671
7-(2,5-difluorophenyl)bicyclo[4.1.0]heptan-7-ol
CID 79330754
9-benzyl-7-(2,5-difluorophenyl)-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol
CID 171958616
cis-(1R,2S)-2-(2,5-difluorophenyl)-2-methylcyclopropane-1-carboxylic acid
CID 94256560
1-(3-fluorophenyl)-3,5-dimethylcyclohexan-1-ol
CID 64735546
1-[(3,4-difluorophenyl)methyl]-3-methylcyclobutan-1-ol
CID 103564715
1-(2,3-difluorophenyl)-3,5-dimethylcyclohexan-1-ol
CID 64736348

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol?
The IUPAC name of 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol (CID 103564462) is 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol.
What is the SMILES notation for 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol?
The canonical SMILES for 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol is CC1CC(O)(c2cc(F)ccc2F)C1.
What is the InChIKey of 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol?
The InChIKey is UIUJCSDFMQNJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2O/c1-7-5-11(14,6-7)9-4-8(12)2-3-10(9)13/h2-4,7,14H,5-6H2,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol?
1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol has a molecular weight of 198.21 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-3-methylcyclobutan-1-ol is sourced from PubChem (CID 103564462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).