2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C11H11F3N2 — CID 168950667

IUPAC2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCC(C)c1cc2cccc(C(F)(F)F)n2n1
InChIInChI=1S/C11H11F3N2/c1-7(2)9-6-8-4-3-5-10(11(12,13)14)16(8)15-9/h3-7H,1-2H3
InChIKeyIDPAYKRBHBZNJZ-UHFFFAOYSA-N
MW228.22 g/mol
LogP3.48
Rot. Bonds1

About 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine

2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 168950667) has the molecular formula C11H11F3N2 and a molecular weight of 228.22 g/mol. Its IUPAC name is 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID168950667
Molecular FormulaC11H11F3N2
Molecular Weight228.22 g/mol
Exact Mass228.09
IUPAC Name2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCC(C)c1cc2cccc(C(F)(F)F)n2n1
InChIInChI=1S/C11H11F3N2/c1-7(2)9-6-8-4-3-5-10(11(12,13)14)16(8)15-9/h3-7H,1-2H3
InChIKeyIDPAYKRBHBZNJZ-UHFFFAOYSA-N
XLogP3.48
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.22
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole
CID 2760581
2-Fluoro-3-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 332941
2,3-Bis(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 12777793
1-Phenyl-3-tert-butyl-5-(trifluoromethyl)-1H-pyrazole
CID 15350115
7-Trifluoromethylpyrazolo[1,5-a]pyridine
CID 123269739
7-Methylpyrazolo[1,5-a]pyridine
CID 583434
2-(2,4-difluorophenyl)-3-methyl-4,5,6,7-tetrahydro-2H-indazole
CID 85915201
4-Butyl-5-methyl-1-phenyl-3-(trifluoromethyl)pyrazole
CID 135065113
3-Cyclobutyl-1-phenyl-5-(trifluoromethyl)pyrazole
CID 135066256
6-Methyl-5-phenyl-2-(trifluoromethyl)pyrazolo[5,1-a]isoquinoline
CID 139093192
5,6-Dipropyl-2-(trifluoromethyl)pyrazolo[5,1-a]isoquinoline
CID 139093196
2-Butylpyrazolo[1,5-a]pyridine
CID 12669576

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 168950667) is 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine is CC(C)c1cc2cccc(C(F)(F)F)n2n1.
What is the InChIKey of 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is IDPAYKRBHBZNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2/c1-7(2)9-6-8-4-3-5-10(11(12,13)14)16(8)15-9/h3-7H,1-2H3.
What are the key properties of 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 228.22 g/mol, XLogP of 3.48, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 168950667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).