5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid

C12H9F3N2O2 — CID 67112128

IUPAC5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cc2cc(C3CC3)cc(C(F)(F)F)n2n1
InChIInChI=1S/C12H9F3N2O2/c13-12(14,15)10-4-7(6-1-2-6)3-8-5-9(11(18)19)16-17(8)10/h3-6H,1-2H2,(H,18,19)
InChIKeySBEIHQQUHLSIBK-UHFFFAOYSA-N
MW270.21 g/mol
LogP2.93
Rot. Bonds2

About 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid

5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid (PubChem CID 67112128) has the molecular formula C12H9F3N2O2 and a molecular weight of 270.21 g/mol. Its IUPAC name is 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
PubChem CID67112128
Molecular FormulaC12H9F3N2O2
Molecular Weight270.21 g/mol
Exact Mass270.06
IUPAC Name5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cc2cc(C3CC3)cc(C(F)(F)F)n2n1
InChIInChI=1S/C12H9F3N2O2/c13-12(14,15)10-4-7(6-1-2-6)3-8-5-9(11(18)19)16-17(8)10/h3-6H,1-2H2,(H,18,19)
InChIKeySBEIHQQUHLSIBK-UHFFFAOYSA-N
XLogP2.93
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.21
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The IUPAC name of 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid (CID 67112128) is 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The canonical SMILES for 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid is O=C(O)c1cc2cc(C3CC3)cc(C(F)(F)F)n2n1.
What is the InChIKey of 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The InChIKey is SBEIHQQUHLSIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F3N2O2/c13-12(14,15)10-4-7(6-1-2-6)3-8-5-9(11(18)19)16-17(8)10/h3-6H,1-2H2,(H,18,19).
What are the key properties of 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid has a molecular weight of 270.21 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 67112128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).