4-(6-azidopyridazin-3-yl)morpholine

C8H10N6O — CID 100974495

IUPAC4-(6-azidopyridazin-3-yl)morpholine
SMILES[N-]=[N+]=Nc1ccc(N2CCOCC2)nn1
InChIInChI=1S/C8H10N6O/c9-13-11-7-1-2-8(12-10-7)14-3-5-15-6-4-14/h1-2H,3-6H2
InChIKeyCFBQKAPTTVKTGD-UHFFFAOYSA-N
MW206.21 g/mol
LogP1.25
Rot. Bonds2

About 4-(6-azidopyridazin-3-yl)morpholine

4-(6-azidopyridazin-3-yl)morpholine (PubChem CID 100974495) has the molecular formula C8H10N6O and a molecular weight of 206.21 g/mol. Its IUPAC name is 4-(6-azidopyridazin-3-yl)morpholine.

Molecular Properties

Compound Name4-(6-azidopyridazin-3-yl)morpholine
PubChem CID100974495
Molecular FormulaC8H10N6O
Molecular Weight206.21 g/mol
Exact Mass206.09
IUPAC Name4-(6-azidopyridazin-3-yl)morpholine
SMILES[N-]=[N+]=Nc1ccc(N2CCOCC2)nn1
InChIInChI=1S/C8H10N6O/c9-13-11-7-1-2-8(12-10-7)14-3-5-15-6-4-14/h1-2H,3-6H2
InChIKeyCFBQKAPTTVKTGD-UHFFFAOYSA-N
XLogP1.25
TPSA87.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(6-azidopyridazin-3-yl)morpholine?
The IUPAC name of 4-(6-azidopyridazin-3-yl)morpholine (CID 100974495) is 4-(6-azidopyridazin-3-yl)morpholine.
What is the SMILES notation for 4-(6-azidopyridazin-3-yl)morpholine?
The canonical SMILES for 4-(6-azidopyridazin-3-yl)morpholine is [N-]=[N+]=Nc1ccc(N2CCOCC2)nn1.
What is the InChIKey of 4-(6-azidopyridazin-3-yl)morpholine?
The InChIKey is CFBQKAPTTVKTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6O/c9-13-11-7-1-2-8(12-10-7)14-3-5-15-6-4-14/h1-2H,3-6H2.
What are the key properties of 4-(6-azidopyridazin-3-yl)morpholine?
4-(6-azidopyridazin-3-yl)morpholine has a molecular weight of 206.21 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-azidopyridazin-3-yl)morpholine is sourced from PubChem (CID 100974495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).