4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine

C9H11N5O — CID 2807620

IUPAC4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
SMILESc1cc2nncn2nc1N1CCOCC1
InChIInChI=1S/C9H11N5O/c1-2-9(13-3-5-15-6-4-13)12-14-7-10-11-8(1)14/h1-2,7H,3-6H2
InChIKeyPIOBJCAIZDYSJN-UHFFFAOYSA-N
MW205.22 g/mol
LogP-0.04
Rot. Bonds1

About 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine

4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine (PubChem CID 2807620) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine.

Molecular Properties

Compound Name4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
PubChem CID2807620
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
SMILESc1cc2nncn2nc1N1CCOCC1
InChIInChI=1S/C9H11N5O/c1-2-9(13-3-5-15-6-4-13)12-14-7-10-11-8(1)14/h1-2,7H,3-6H2
InChIKeyPIOBJCAIZDYSJN-UHFFFAOYSA-N
XLogP-0.04
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The IUPAC name of 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine (CID 2807620) is 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine.
What is the SMILES notation for 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The canonical SMILES for 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine is c1cc2nncn2nc1N1CCOCC1.
What is the InChIKey of 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The InChIKey is PIOBJCAIZDYSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-2-9(13-3-5-15-6-4-13)12-14-7-10-11-8(1)14/h1-2,7H,3-6H2.
What are the key properties of 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine has a molecular weight of 205.22 g/mol, XLogP of -0.04, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine is sourced from PubChem (CID 2807620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).