2-cyclobutyl-1-(2-fluorophenyl)ethanol

C12H15FO — CID 65458117

IUPAC2-cyclobutyl-1-(2-fluorophenyl)ethanol
SMILESOC(CC1CCC1)c1ccccc1F
InChIInChI=1S/C12H15FO/c13-11-7-2-1-6-10(11)12(14)8-9-4-3-5-9/h1-2,6-7,9,12,14H,3-5,8H2
InChIKeyULMGVCKFJBIQQU-UHFFFAOYSA-N
MW194.25 g/mol
LogP3.05
Rot. Bonds3

About 2-cyclobutyl-1-(2-fluorophenyl)ethanol

2-cyclobutyl-1-(2-fluorophenyl)ethanol (PubChem CID 65458117) has the molecular formula C12H15FO and a molecular weight of 194.25 g/mol. Its IUPAC name is 2-cyclobutyl-1-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-cyclobutyl-1-(2-fluorophenyl)ethanol
PubChem CID65458117
Molecular FormulaC12H15FO
Molecular Weight194.25 g/mol
Exact Mass194.11
IUPAC Name2-cyclobutyl-1-(2-fluorophenyl)ethanol
SMILESOC(CC1CCC1)c1ccccc1F
InChIInChI=1S/C12H15FO/c13-11-7-2-1-6-10(11)12(14)8-9-4-3-5-9/h1-2,6-7,9,12,14H,3-5,8H2
InChIKeyULMGVCKFJBIQQU-UHFFFAOYSA-N
XLogP3.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986373
1-(3-chloro-2-fluorophenyl)-2-cyclobutylethanol
CID 65459936
2-cyclopentyl-1-(2,5-difluorophenyl)ethanol
CID 61101489
3-cyclopentyl-2-(2-fluorophenyl)propan-1-ol
CID 79448648
[2-cyclopropyl-1-(2-fluorophenyl)ethyl]hydrazine
CID 105216734
1-(4-chloro-2-fluorophenyl)-2-cyclohexylethanol
CID 63083124
1-(2-chloro-4,5-difluorophenyl)-2-cyclobutylethanol
CID 107477114
2-cyclopentyl-1-(2-ethylphenyl)ethanol
CID 65150347
2-[4-(cyclohexylmethyl)piperazin-1-yl]-1-(2-fluorophenyl)ethanol
CID 110908424
1-(4-bromo-2,5-difluorophenyl)-2-cyclobutylethanol
CID 103165469
(4-ethylcyclohexyl)-(2-fluorophenyl)methanol
CID 64749746
2-[bis(cyclopropylmethyl)amino]-1-(2-fluorophenyl)ethanol
CID 103670661

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(2-fluorophenyl)ethanol?
The IUPAC name of 2-cyclobutyl-1-(2-fluorophenyl)ethanol (CID 65458117) is 2-cyclobutyl-1-(2-fluorophenyl)ethanol.
What is the SMILES notation for 2-cyclobutyl-1-(2-fluorophenyl)ethanol?
The canonical SMILES for 2-cyclobutyl-1-(2-fluorophenyl)ethanol is OC(CC1CCC1)c1ccccc1F.
What is the InChIKey of 2-cyclobutyl-1-(2-fluorophenyl)ethanol?
The InChIKey is ULMGVCKFJBIQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO/c13-11-7-2-1-6-10(11)12(14)8-9-4-3-5-9/h1-2,6-7,9,12,14H,3-5,8H2.
What are the key properties of 2-cyclobutyl-1-(2-fluorophenyl)ethanol?
2-cyclobutyl-1-(2-fluorophenyl)ethanol has a molecular weight of 194.25 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1-(2-fluorophenyl)ethanol is sourced from PubChem (CID 65458117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).