5-amino-6-indazol-1-ylpyridine-3-carboxylic acid

C13H10N4O2 — CID 81439613

IUPAC5-amino-6-indazol-1-ylpyridine-3-carboxylic acid
SMILESNc1cc(C(=O)O)cnc1-n1ncc2ccccc21
InChIInChI=1S/C13H10N4O2/c14-10-5-9(13(18)19)6-15-12(10)17-11-4-2-1-3-8(11)7-16-17/h1-7H,14H2,(H,18,19)
InChIKeyHXTOEWWBCZYQIJ-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.70
Rot. Bonds2

About 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid

5-amino-6-indazol-1-ylpyridine-3-carboxylic acid (PubChem CID 81439613) has the molecular formula C13H10N4O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-indazol-1-ylpyridine-3-carboxylic acid
PubChem CID81439613
Molecular FormulaC13H10N4O2
Molecular Weight254.25 g/mol
Exact Mass254.08
IUPAC Name5-amino-6-indazol-1-ylpyridine-3-carboxylic acid
SMILESNc1cc(C(=O)O)cnc1-n1ncc2ccccc21
InChIInChI=1S/C13H10N4O2/c14-10-5-9(13(18)19)6-15-12(10)17-11-4-2-1-3-8(11)7-16-17/h1-7H,14H2,(H,18,19)
InChIKeyHXTOEWWBCZYQIJ-UHFFFAOYSA-N
XLogP1.70
TPSA94.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid?
The IUPAC name of 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid (CID 81439613) is 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid.
What is the SMILES notation for 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid?
The canonical SMILES for 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid is Nc1cc(C(=O)O)cnc1-n1ncc2ccccc21.
What is the InChIKey of 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid?
The InChIKey is HXTOEWWBCZYQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O2/c14-10-5-9(13(18)19)6-15-12(10)17-11-4-2-1-3-8(11)7-16-17/h1-7H,14H2,(H,18,19).
What are the key properties of 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid?
5-amino-6-indazol-1-ylpyridine-3-carboxylic acid has a molecular weight of 254.25 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-indazol-1-ylpyridine-3-carboxylic acid is sourced from PubChem (CID 81439613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).