1-hydroxyindazol-5-amine

C7H7N3O — CID 144847821

IUPAC1-hydroxyindazol-5-amine
SMILESNc1ccc2c(cnn2O)c1
InChIInChI=1S/C7H7N3O/c8-6-1-2-7-5(3-6)4-9-10(7)11/h1-4,11H,8H2
InChIKeyJPNAMAXQZIORJR-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.86
Rot. Bonds

About 1-hydroxyindazol-5-amine

1-hydroxyindazol-5-amine (PubChem CID 144847821) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 1-hydroxyindazol-5-amine.

Molecular Properties

Compound Name1-hydroxyindazol-5-amine
PubChem CID144847821
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name1-hydroxyindazol-5-amine
SMILESNc1ccc2c(cnn2O)c1
InChIInChI=1S/C7H7N3O/c8-6-1-2-7-5(3-6)4-9-10(7)11/h1-4,11H,8H2
InChIKeyJPNAMAXQZIORJR-UHFFFAOYSA-N
XLogP0.86
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxyindazol-5-amine?
The IUPAC name of 1-hydroxyindazol-5-amine (CID 144847821) is 1-hydroxyindazol-5-amine.
What is the SMILES notation for 1-hydroxyindazol-5-amine?
The canonical SMILES for 1-hydroxyindazol-5-amine is Nc1ccc2c(cnn2O)c1.
What is the InChIKey of 1-hydroxyindazol-5-amine?
The InChIKey is JPNAMAXQZIORJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c8-6-1-2-7-5(3-6)4-9-10(7)11/h1-4,11H,8H2.
What are the key properties of 1-hydroxyindazol-5-amine?
1-hydroxyindazol-5-amine has a molecular weight of 149.15 g/mol, XLogP of 0.86, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxyindazol-5-amine is sourced from PubChem (CID 144847821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).