6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid

C11H11N3O2 — CID 19616513

IUPAC6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCn1ncc2c(C(=O)O)cc(C3CC3)nc21
InChIInChI=1S/C11H11N3O2/c1-14-10-8(5-12-14)7(11(15)16)4-9(13-10)6-2-3-6/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyGRXOHEXNROQVRY-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.54
Rot. Bonds2

About 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid

6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid (PubChem CID 19616513) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid
PubChem CID19616513
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCn1ncc2c(C(=O)O)cc(C3CC3)nc21
InChIInChI=1S/C11H11N3O2/c1-14-10-8(5-12-14)7(11(15)16)4-9(13-10)6-2-3-6/h4-6H,2-3H2,1H3,(H,15,16)
InChIKeyGRXOHEXNROQVRY-UHFFFAOYSA-N
XLogP1.54
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid (CID 19616513) is 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid is Cn1ncc2c(C(=O)O)cc(C3CC3)nc21.
What is the InChIKey of 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The InChIKey is GRXOHEXNROQVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-14-10-8(5-12-14)7(11(15)16)4-9(13-10)6-2-3-6/h4-6H,2-3H2,1H3,(H,15,16).
What are the key properties of 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid has a molecular weight of 217.23 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 19616513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).