6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid

C13H15N3O2 — CID 2525992

IUPAC6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCC(C)n1ncc2c(C(=O)O)cc(C3CC3)nc21
InChIInChI=1S/C13H15N3O2/c1-7(2)16-12-10(6-14-16)9(13(17)18)5-11(15-12)8-3-4-8/h5-8H,3-4H2,1-2H3,(H,17,18)
InChIKeyYZDILIKIHKVAHO-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.59
Rot. Bonds3

About 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid

6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid (PubChem CID 2525992) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
PubChem CID2525992
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCC(C)n1ncc2c(C(=O)O)cc(C3CC3)nc21
InChIInChI=1S/C13H15N3O2/c1-7(2)16-12-10(6-14-16)9(13(17)18)5-11(15-12)8-3-4-8/h5-8H,3-4H2,1-2H3,(H,17,18)
InChIKeyYZDILIKIHKVAHO-UHFFFAOYSA-N
XLogP2.59
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid (CID 2525992) is 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid is CC(C)n1ncc2c(C(=O)O)cc(C3CC3)nc21.
What is the InChIKey of 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The InChIKey is YZDILIKIHKVAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-7(2)16-12-10(6-14-16)9(13(17)18)5-11(15-12)8-3-4-8/h5-8H,3-4H2,1-2H3,(H,17,18).
What are the key properties of 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid has a molecular weight of 245.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 2525992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).