3-(trifluoromethyl)pyrazol-3-ol

C4H3F3N2O — CID 162534475

IUPAC3-(trifluoromethyl)pyrazol-3-ol
SMILESOC1(C(F)(F)F)C=CN=N1
InChIInChI=1S/C4H3F3N2O/c5-4(6,7)3(10)1-2-8-9-3/h1-2,10H
InChIKeyDGKUIMFJEGNQSQ-UHFFFAOYSA-N
MW152.08 g/mol
LogP1.22
Rot. Bonds

About 3-(trifluoromethyl)pyrazol-3-ol

3-(trifluoromethyl)pyrazol-3-ol (PubChem CID 162534475) has the molecular formula C4H3F3N2O and a molecular weight of 152.08 g/mol. Its IUPAC name is 3-(trifluoromethyl)pyrazol-3-ol.

Molecular Properties

Compound Name3-(trifluoromethyl)pyrazol-3-ol
PubChem CID162534475
Molecular FormulaC4H3F3N2O
Molecular Weight152.08 g/mol
Exact Mass152.02
IUPAC Name3-(trifluoromethyl)pyrazol-3-ol
SMILESOC1(C(F)(F)F)C=CN=N1
InChIInChI=1S/C4H3F3N2O/c5-4(6,7)3(10)1-2-8-9-3/h1-2,10H
InChIKeyDGKUIMFJEGNQSQ-UHFFFAOYSA-N
XLogP1.22
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.08
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-(trifluoromethyl)cyclopentan-1-ol
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1-(trifluoromethyl)cyclobutan-1-ol;hydrochloride
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CID 22468102
CID 22468102
3-bromo-3-(difluoromethyl)pyrazole
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(3S)-3-methylpyrazol-3-amine
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1-pyrimidin-2-yl-4-(trifluoromethyl)piperidin-4-ol
CID 126851853
3-[4-methyl-3-(2,2,2-trifluoroethylsulfanyl)phenyl]-3-(trifluoromethyl)pyrazole
CID 22170949
oxolane;4-(trifluoromethyl)piperidin-4-ol
CID 175226361
2,2,2-trifluoro-1-[3-(trifluoromethyl)diazirin-3-yl]ethane-1,1-diol
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Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethyl)pyrazol-3-ol?
The IUPAC name of 3-(trifluoromethyl)pyrazol-3-ol (CID 162534475) is 3-(trifluoromethyl)pyrazol-3-ol.
What is the SMILES notation for 3-(trifluoromethyl)pyrazol-3-ol?
The canonical SMILES for 3-(trifluoromethyl)pyrazol-3-ol is OC1(C(F)(F)F)C=CN=N1.
What is the InChIKey of 3-(trifluoromethyl)pyrazol-3-ol?
The InChIKey is DGKUIMFJEGNQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F3N2O/c5-4(6,7)3(10)1-2-8-9-3/h1-2,10H.
What are the key properties of 3-(trifluoromethyl)pyrazol-3-ol?
3-(trifluoromethyl)pyrazol-3-ol has a molecular weight of 152.08 g/mol, XLogP of 1.22, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethyl)pyrazol-3-ol is sourced from PubChem (CID 162534475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).