2-(3-fluorophenyl)-2-methylcyclobutan-1-ol

C11H13FO — CID 130118878

IUPAC2-(3-fluorophenyl)-2-methylcyclobutan-1-ol
SMILESCC1(c2cccc(F)c2)CCC1O
InChIInChI=1S/C11H13FO/c1-11(6-5-10(11)13)8-3-2-4-9(12)7-8/h2-4,7,10,13H,5-6H2,1H3
InChIKeyQPHCXEKETABYGF-UHFFFAOYSA-N
MW180.22 g/mol
LogP2.24
Rot. Bonds1

About 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol

2-(3-fluorophenyl)-2-methylcyclobutan-1-ol (PubChem CID 130118878) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-methylcyclobutan-1-ol
PubChem CID130118878
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name2-(3-fluorophenyl)-2-methylcyclobutan-1-ol
SMILESCC1(c2cccc(F)c2)CCC1O
InChIInChI=1S/C11H13FO/c1-11(6-5-10(11)13)8-3-2-4-9(12)7-8/h2-4,7,10,13H,5-6H2,1H3
InChIKeyQPHCXEKETABYGF-UHFFFAOYSA-N
XLogP2.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
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(1R)-2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
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1-fluoro-3-(1-methylcyclopropyl)benzene
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[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
CID 81358099
1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine
CID 62703823
1-(3-fluorophenyl)-3-methylcyclopentan-1-ol
CID 64516449
1-(3-fluorophenyl)-2-methylcyclopropan-1-ol
CID 79333941
2-(3-fluorophenyl)-2-methyloxolan-3-amine
CID 105449016
2-(3-fluorophenyl)-2-methyloxolane-3-carboxylic acid
CID 105481638
1-(3-fluorophenyl)-2,4-dimethylcyclohexan-1-ol
CID 64756021
3-(3-fluorophenyl)-3-methyl-2-(2-methylpropyl)pyrrolidine
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methyl 4-(3-fluorophenyl)-4-methylpyrrolidine-3-carboxylate
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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol?
The IUPAC name of 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol (CID 130118878) is 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol.
What is the SMILES notation for 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol?
The canonical SMILES for 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol is CC1(c2cccc(F)c2)CCC1O.
What is the InChIKey of 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol?
The InChIKey is QPHCXEKETABYGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-11(6-5-10(11)13)8-3-2-4-9(12)7-8/h2-4,7,10,13H,5-6H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol?
2-(3-fluorophenyl)-2-methylcyclobutan-1-ol has a molecular weight of 180.22 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-methylcyclobutan-1-ol is sourced from PubChem (CID 130118878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).