4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol

C11H15F3N2O — CID 122633452

IUPAC4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol
SMILESCc1cc(C(F)(F)F)nn1C1CCC(O)CC1
InChIInChI=1S/C11H15F3N2O/c1-7-6-10(11(12,13)14)15-16(7)8-2-4-9(17)5-3-8/h6,8-9,17H,2-5H2,1H3
InChIKeyBADNUYLDVGFGAL-UHFFFAOYSA-N
MW248.25 g/mol
LogP2.69
Rot. Bonds1

About 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol

4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol (PubChem CID 122633452) has the molecular formula C11H15F3N2O and a molecular weight of 248.25 g/mol. Its IUPAC name is 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol
PubChem CID122633452
Molecular FormulaC11H15F3N2O
Molecular Weight248.25 g/mol
Exact Mass248.11
IUPAC Name4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol
SMILESCc1cc(C(F)(F)F)nn1C1CCC(O)CC1
InChIInChI=1S/C11H15F3N2O/c1-7-6-10(11(12,13)14)15-16(7)8-2-4-9(17)5-3-8/h6,8-9,17H,2-5H2,1H3
InChIKeyBADNUYLDVGFGAL-UHFFFAOYSA-N
XLogP2.69
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-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

2-[5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-YL]ethanol
CID 19619759
2-[3-Methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]ethanol
CID 89833798
3-(1-Methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl)propan-1-ol
CID 75175982
1-Cyclohexyl-5-methyl-3-(trifluoromethyl)pyrazole
CID 57780195
4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]cyclohexanol
CID 59556146
1-[2-Ethyl-5-(trifluoromethyl)pyrazol-3-yl]ethanol
CID 70851924
2-[4-[5-Methyl-3-(trifluoromethyl)pyrazol-1-yl]piperidin-1-yl]ethanol
CID 118149713
4-[5-Methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1,2-diol
CID 122633563
3-[5-Methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 122633606
1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-fluoropropan-2-ol
CID 131071192
4-[5-Propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol
CID 134331554
4-[5-Ethyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1,2-diol
CID 134331572

Frequently Asked Questions

What is the IUPAC name of 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol?
The IUPAC name of 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol (CID 122633452) is 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol.
What is the SMILES notation for 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol?
The canonical SMILES for 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol is Cc1cc(C(F)(F)F)nn1C1CCC(O)CC1.
What is the InChIKey of 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol?
The InChIKey is BADNUYLDVGFGAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O/c1-7-6-10(11(12,13)14)15-16(7)8-2-4-9(17)5-3-8/h6,8-9,17H,2-5H2,1H3.
What are the key properties of 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol?
4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol has a molecular weight of 248.25 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclohexan-1-ol is sourced from PubChem (CID 122633452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).