6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine

C11H8F3N5 — CID 175743636

IUPAC6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
SMILESCn1cc(-c2cn3ncc(C(F)(F)F)c3cn2)cn1
InChIInChI=1S/C11H8F3N5/c1-18-5-7(2-16-18)9-6-19-10(4-15-9)8(3-17-19)11(12,13)14/h2-6H,1H3
InChIKeyRUFCUOKGLJETBE-UHFFFAOYSA-N
MW267.21 g/mol
LogP2.15
Rot. Bonds1

About 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine

6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine (PubChem CID 175743636) has the molecular formula C11H8F3N5 and a molecular weight of 267.21 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
PubChem CID175743636
Molecular FormulaC11H8F3N5
Molecular Weight267.21 g/mol
Exact Mass267.07
IUPAC Name6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
SMILESCn1cc(-c2cn3ncc(C(F)(F)F)c3cn2)cn1
InChIInChI=1S/C11H8F3N5/c1-18-5-7(2-16-18)9-6-19-10(4-15-9)8(3-17-19)11(12,13)14/h2-6H,1H3
InChIKeyRUFCUOKGLJETBE-UHFFFAOYSA-N
XLogP2.15
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.21
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrazine
CID 121378289
6,7-Dimethylpyrazolo(1,5-a)pyrazin-3-amine dihydrochloride
CID 165770821
4-[1-(1,1,1-Trifluorobutan-2-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrazine
CID 141494795
4-[1-[(3S)-2,2-difluoropentan-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazine
CID 141494799
1-Methyl-4-[3-(trifluoromethyl)pyrrol-1-yl]pyrazole
CID 146289657
2-[1-(2,2-Difluoroethyl)pyrazol-4-yl]-6-propan-2-ylpyrazine
CID 168209361
6-(1-Methylpyrazol-4-yl)-3-piperazin-4-ium-1-ylpyrazolo[1,5-a]pyrazine;2,2,2-trifluoroacetate
CID 169784539
3-Fluoro-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
CID 172810484
7-Fluoropyrazolo[1,5-a]pyrazine
CID 176894498
7-(Trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 176894499
Ethane;6-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 177972712
6-(Difluoromethyl)-3-iodopyrazolo[1,5-a]pyrazine
CID 178051748

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine (CID 175743636) is 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine is Cn1cc(-c2cn3ncc(C(F)(F)F)c3cn2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine?
The InChIKey is RUFCUOKGLJETBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N5/c1-18-5-7(2-16-18)9-6-19-10(4-15-9)8(3-17-19)11(12,13)14/h2-6H,1H3.
What are the key properties of 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine?
6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine has a molecular weight of 267.21 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 175743636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).