5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol

C10H9F3N2O — CID 4519188

IUPAC5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol
SMILESOC1(C(F)(F)F)C=C(c2ccccc2)NN1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)9(16)6-8(14-15-9)7-4-2-1-3-5-7/h1-6,14-16H
InChIKeyPKTZYJLNHXOSEU-UHFFFAOYSA-N
MW230.19 g/mol
LogP1.39
Rot. Bonds1

About 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol

5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol (PubChem CID 4519188) has the molecular formula C10H9F3N2O and a molecular weight of 230.19 g/mol. Its IUPAC name is 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol.

Molecular Properties

Compound Name5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol
PubChem CID4519188
Molecular FormulaC10H9F3N2O
Molecular Weight230.19 g/mol
Exact Mass230.07
IUPAC Name5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol
SMILESOC1(C(F)(F)F)C=C(c2ccccc2)NN1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)9(16)6-8(14-15-9)7-4-2-1-3-5-7/h1-6,14-16H
InChIKeyPKTZYJLNHXOSEU-UHFFFAOYSA-N
XLogP1.39
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-phenyl-5-(trifluoromethyl)-2H-1,2-oxazol-5-ol
CID 5056306
3-hydroxy-5-phenyl-3-(trifluoromethyl)-1H-pyrazole-2-carbaldehyde
CID 3479499
1-[5-(4-fluorophenyl)-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]ethanone
CID 4249218
(3R)-5-(2-phenylethenyl)-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol
CID 7007474
2-methyl-6-phenyl-3-(trifluoromethyl)-1H-pyridazin-5-ol
CID 134106923
2,5-dimethyl-3-phenyl-1H-pyrazol-5-ol
CID 124095371
3-Methyl-5-(2-phenylethyl)-1,2-dihydropyrazol-3-ol
CID 142995897
3-Methyl-5-(4-methylphenyl)-1,2-dihydropyrazol-3-ol
CID 142995901

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol?
The IUPAC name of 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol (CID 4519188) is 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol.
What is the SMILES notation for 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol?
The canonical SMILES for 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol is OC1(C(F)(F)F)C=C(c2ccccc2)NN1.
What is the InChIKey of 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol?
The InChIKey is PKTZYJLNHXOSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O/c11-10(12,13)9(16)6-8(14-15-9)7-4-2-1-3-5-7/h1-6,14-16H.
What are the key properties of 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol?
5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol has a molecular weight of 230.19 g/mol, XLogP of 1.39, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(trifluoromethyl)-1,2-dihydropyrazol-3-ol is sourced from PubChem (CID 4519188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).