1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol

C11H10F4O — CID 117339844

IUPAC1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol
SMILESOC1(Cc2cccc(F)c2C(F)(F)F)CC1
InChIInChI=1S/C11H10F4O/c12-8-3-1-2-7(6-10(16)4-5-10)9(8)11(13,14)15/h1-3,16H,4-6H2
InChIKeyQGLSZCOKUIFOHK-UHFFFAOYSA-N
MW234.19 g/mol
LogP2.91
Rot. Bonds2

About 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol

1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol (PubChem CID 117339844) has the molecular formula C11H10F4O and a molecular weight of 234.19 g/mol. Its IUPAC name is 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol
PubChem CID117339844
Molecular FormulaC11H10F4O
Molecular Weight234.19 g/mol
Exact Mass234.07
IUPAC Name1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol
SMILESOC1(Cc2cccc(F)c2C(F)(F)F)CC1
InChIInChI=1S/C11H10F4O/c12-8-3-1-2-7(6-10(16)4-5-10)9(8)11(13,14)15/h1-3,16H,4-6H2
InChIKeyQGLSZCOKUIFOHK-UHFFFAOYSA-N
XLogP2.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol 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

1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-amine
CID 117337409
N-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]hydroxylamine
CID 117298129
1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol
CID 117339846
2-[3-fluoro-2-(trifluoromethyl)phenyl]ethanamine
CID 84674830
1-[(2-chloro-3-fluorophenyl)methyl]-4-(trifluoromethyl)cyclohexan-1-ol
CID 115983401
1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol
CID 117289578
1-[(2,6-difluorophenyl)methyl]-4,4-dimethylcyclohexan-1-ol
CID 114931035
4-[(2,3-difluorophenyl)methyl]azepan-4-ol
CID 103982867
1-[(2,3-difluorophenyl)methyl]-4-ethylcyclohexan-1-ol
CID 65147733
4-[(2,3-difluorophenyl)methyl]-1-ethylpiperidin-4-ol
CID 65147067
4-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidine
CID 84806750
1-[[5-(1,1-difluoroethyl)-2-fluorophenyl]methyl]cyclopropan-1-ol
CID 117332255

Frequently Asked Questions

What is the IUPAC name of 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol (CID 117339844) is 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol is OC1(Cc2cccc(F)c2C(F)(F)F)CC1.
What is the InChIKey of 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol?
The InChIKey is QGLSZCOKUIFOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F4O/c12-8-3-1-2-7(6-10(16)4-5-10)9(8)11(13,14)15/h1-3,16H,4-6H2.
What are the key properties of 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol?
1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol has a molecular weight of 234.19 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]cyclopropan-1-ol is sourced from PubChem (CID 117339844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).