5-iodopyrazolo[1,5-a]pyridin-3-amine

C7H6IN3 — CID 130048259

IUPAC5-iodopyrazolo[1,5-a]pyridin-3-amine
SMILESNc1cnn2ccc(I)cc12
InChIInChI=1S/C7H6IN3/c8-5-1-2-11-7(3-5)6(9)4-10-11/h1-4H,9H2
InChIKeyNIUIBMJYCMKCKU-UHFFFAOYSA-N
MW259.05 g/mol
LogP1.52
Rot. Bonds

About 5-iodopyrazolo[1,5-a]pyridin-3-amine

5-iodopyrazolo[1,5-a]pyridin-3-amine (PubChem CID 130048259) has the molecular formula C7H6IN3 and a molecular weight of 259.05 g/mol. Its IUPAC name is 5-iodopyrazolo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name5-iodopyrazolo[1,5-a]pyridin-3-amine
PubChem CID130048259
Molecular FormulaC7H6IN3
Molecular Weight259.05 g/mol
Exact Mass258.96
IUPAC Name5-iodopyrazolo[1,5-a]pyridin-3-amine
SMILESNc1cnn2ccc(I)cc12
InChIInChI=1S/C7H6IN3/c8-5-1-2-11-7(3-5)6(9)4-10-11/h1-4H,9H2
InChIKeyNIUIBMJYCMKCKU-UHFFFAOYSA-N
XLogP1.52
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.05
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-iodopyrazolo[1,5-a]pyridin-3-amine?
The IUPAC name of 5-iodopyrazolo[1,5-a]pyridin-3-amine (CID 130048259) is 5-iodopyrazolo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 5-iodopyrazolo[1,5-a]pyridin-3-amine?
The canonical SMILES for 5-iodopyrazolo[1,5-a]pyridin-3-amine is Nc1cnn2ccc(I)cc12.
What is the InChIKey of 5-iodopyrazolo[1,5-a]pyridin-3-amine?
The InChIKey is NIUIBMJYCMKCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6IN3/c8-5-1-2-11-7(3-5)6(9)4-10-11/h1-4H,9H2.
What are the key properties of 5-iodopyrazolo[1,5-a]pyridin-3-amine?
5-iodopyrazolo[1,5-a]pyridin-3-amine has a molecular weight of 259.05 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodopyrazolo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 130048259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).