3-amino-1H-indazole-5-carboxylic acid

C8H7N3O2 — CID 11571884

IUPAC3-amino-1H-indazole-5-carboxylic acid
SMILESNc1n[nH]c2ccc(C(=O)O)cc12
InChIInChI=1S/C8H7N3O2/c9-7-5-3-4(8(12)13)1-2-6(5)10-11-7/h1-3H,(H,12,13)(H3,9,10,11)
InChIKeyYEGQMUOUKUEJRM-UHFFFAOYSA-N
MW177.16 g/mol
LogP0.84
Rot. Bonds1

About 3-amino-1H-indazole-5-carboxylic acid

3-amino-1H-indazole-5-carboxylic acid (PubChem CID 11571884) has the molecular formula C8H7N3O2 and a molecular weight of 177.16 g/mol. Its IUPAC name is 3-amino-1H-indazole-5-carboxylic acid.

Molecular Properties

Compound Name3-amino-1H-indazole-5-carboxylic acid
PubChem CID11571884
Molecular FormulaC8H7N3O2
Molecular Weight177.16 g/mol
Exact Mass177.05
IUPAC Name3-amino-1H-indazole-5-carboxylic acid
SMILESNc1n[nH]c2ccc(C(=O)O)cc12
InChIInChI=1S/C8H7N3O2/c9-7-5-3-4(8(12)13)1-2-6(5)10-11-7/h1-3H,(H,12,13)(H3,9,10,11)
InChIKeyYEGQMUOUKUEJRM-UHFFFAOYSA-N
XLogP0.84
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-1H-indazole-5-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 3-amino-1H-indazole-5-carboxylic acid?
The IUPAC name of 3-amino-1H-indazole-5-carboxylic acid (CID 11571884) is 3-amino-1H-indazole-5-carboxylic acid.
What is the SMILES notation for 3-amino-1H-indazole-5-carboxylic acid?
The canonical SMILES for 3-amino-1H-indazole-5-carboxylic acid is Nc1n[nH]c2ccc(C(=O)O)cc12.
What is the InChIKey of 3-amino-1H-indazole-5-carboxylic acid?
The InChIKey is YEGQMUOUKUEJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2/c9-7-5-3-4(8(12)13)1-2-6(5)10-11-7/h1-3H,(H,12,13)(H3,9,10,11).
What are the key properties of 3-amino-1H-indazole-5-carboxylic acid?
3-amino-1H-indazole-5-carboxylic acid has a molecular weight of 177.16 g/mol, XLogP of 0.84, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1H-indazole-5-carboxylic acid is sourced from PubChem (CID 11571884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).