4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane

C12H15F3N2 — CID 145498083

IUPAC4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane
SMILESCC.Cc1ccc(C)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C10H9F3N2.C2H6/c1-6-3-4-7(2)15-8(6)5-9(14-15)10(11,12)13;1-2/h3-5H,1-2H3;1-2H3
InChIKeyUKNWVAMXTSCIOW-UHFFFAOYSA-N
MW244.26 g/mol
LogP4.00
Rot. Bonds

About 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane

4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane (PubChem CID 145498083) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane.

Molecular Properties

Compound Name4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane
PubChem CID145498083
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC Name4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane
SMILESCC.Cc1ccc(C)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C10H9F3N2.C2H6/c1-6-3-4-7(2)15-8(6)5-9(14-15)10(11,12)13;1-2/h3-5H,1-2H3;1-2H3
InChIKeyUKNWVAMXTSCIOW-UHFFFAOYSA-N
XLogP4.00
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4,5,7-tetramethyl-6-phenyl-6H-pyrrolo[3,4-d]pyridazine
CID 4874234
1,5-Diphenyl-3-methyl-1H-pyrazole
CID 5191592
1,4,5,7-Tetramethyl-6-(4-methylphenyl)pyrrolo[3,4-d]pyridazine
CID 921199
1,5-Diphenyl-3-trifluoromethyl-1H-pyrazole
CID 10424186
1-methyl-3-phenyl-6-(trifluoromethyl)-1H-pyrazolo[4,3-b]pyridine
CID 1480373
3-Propyl-1,2,3,4-tetrahydro-3,8a,9-triaza-fluorene
CID 44316315
2-(3-Fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71814125
3-methyl-1-phenyl-1H-indazole
CID 11367779
3-phenyl-2-[4-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-2H-indazole
CID 16739355
2-[3-(Trifluoromethyl)phenyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71814123
1,5-dip-tolyl-3-(trifluoromethyl)-1H-pyrazole
CID 22965614
1-phenyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole
CID 2760581

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane?
The IUPAC name of 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane (CID 145498083) is 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane.
What is the SMILES notation for 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane?
The canonical SMILES for 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane is CC.Cc1ccc(C)n2nc(C(F)(F)F)cc12.
What is the InChIKey of 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane?
The InChIKey is UKNWVAMXTSCIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2.C2H6/c1-6-3-4-7(2)15-8(6)5-9(14-15)10(11,12)13;1-2/h3-5H,1-2H3;1-2H3.
What are the key properties of 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane?
4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane has a molecular weight of 244.26 g/mol, XLogP of 4.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine;ethane is sourced from PubChem (CID 145498083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).