5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine

C10H8N6 — CID 103294017

IUPAC5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine
SMILESNc1cncc(-c2nnc3cccnn23)c1
InChIInChI=1S/C10H8N6/c11-8-4-7(5-12-6-8)10-15-14-9-2-1-3-13-16(9)10/h1-6H,11H2
InChIKeyTURKCBQVAOGRRX-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.77
Rot. Bonds1

About 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine

5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine (PubChem CID 103294017) has the molecular formula C10H8N6 and a molecular weight of 212.22 g/mol. Its IUPAC name is 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine
PubChem CID103294017
Molecular FormulaC10H8N6
Molecular Weight212.22 g/mol
Exact Mass212.08
IUPAC Name5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine
SMILESNc1cncc(-c2nnc3cccnn23)c1
InChIInChI=1S/C10H8N6/c11-8-4-7(5-12-6-8)10-15-14-9-2-1-3-13-16(9)10/h1-6H,11H2
InChIKeyTURKCBQVAOGRRX-UHFFFAOYSA-N
XLogP0.77
TPSA81.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine?
The IUPAC name of 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine (CID 103294017) is 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine.
What is the SMILES notation for 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine?
The canonical SMILES for 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine is Nc1cncc(-c2nnc3cccnn23)c1.
What is the InChIKey of 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine?
The InChIKey is TURKCBQVAOGRRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6/c11-8-4-7(5-12-6-8)10-15-14-9-2-1-3-13-16(9)10/h1-6H,11H2.
What are the key properties of 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine?
5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine has a molecular weight of 212.22 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-([1,2,4]triazolo[4,3-b]pyridazin-3-yl)pyridin-3-amine is sourced from PubChem (CID 103294017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).