2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole

C10H9F3N2 — CID 19896882

IUPAC2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole
SMILESFC(F)(F)c1ccc(N2C=CCN2)cc1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)8-2-4-9(5-3-8)15-7-1-6-14-15/h1-5,7,14H,6H2
InChIKeyQZEUHBVENKLQJH-UHFFFAOYSA-N
MW214.19 g/mol
LogP2.54
Rot. Bonds1

About 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole

2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole (PubChem CID 19896882) has the molecular formula C10H9F3N2 and a molecular weight of 214.19 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole
PubChem CID19896882
Molecular FormulaC10H9F3N2
Molecular Weight214.19 g/mol
Exact Mass214.07
IUPAC Name2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole
SMILESFC(F)(F)c1ccc(N2C=CCN2)cc1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)8-2-4-9(5-3-8)15-7-1-6-14-15/h1-5,7,14H,6H2
InChIKeyQZEUHBVENKLQJH-UHFFFAOYSA-N
XLogP2.54
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridin-2-one
CID 58016522
1-(2,6-difluoro-4-methylphenyl)-4-[4-(trifluoromethyl)phenyl]piperazine
CID 71080668
1-[4-(trifluoromethyl)phenyl]pyrazolidine-3,5-dione
CID 131870999
2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine;hydrochloride
CID 69041767
2,2,2-trifluoroacetate;1-[4-(trifluoromethyl)phenyl]piperazine
CID 46779053
1-methyl-4-(trifluoromethyl)benzene bromide
CID 158317252
chloromethane;1-chloro-4-(trifluoromethyl)benzene
CID 162019017
1-(4-fluorophenyl)-8-[4-(trifluoromethyl)phenyl]-6,7-dihydro-5H-1,7-naphthyridine
CID 68900487
3-propan-2-yl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 64925755
1-[(1S)-2,2,2-trifluoro-1-[2-fluoro-4-(trifluoromethyl)phenyl]ethyl]piperazine
CID 171176590
4-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione
CID 12904385
1-[bromo(difluoro)methyl]-4-(trifluoromethyl)benzene
CID 640457

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole?
The IUPAC name of 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole (CID 19896882) is 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole.
What is the SMILES notation for 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole?
The canonical SMILES for 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole is FC(F)(F)c1ccc(N2C=CCN2)cc1.
What is the InChIKey of 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole?
The InChIKey is QZEUHBVENKLQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2/c11-10(12,13)8-2-4-9(5-3-8)15-7-1-6-14-15/h1-5,7,14H,6H2.
What are the key properties of 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole?
2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole has a molecular weight of 214.19 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)phenyl]-1,5-dihydropyrazole is sourced from PubChem (CID 19896882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).