3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

C14H22N6O — CID 133294787

IUPAC3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
SMILESCc1nnc2ccc(NC(C)C(C)N3CCOCC3)nn12
InChIInChI=1S/C14H22N6O/c1-10(11(2)19-6-8-21-9-7-19)15-13-4-5-14-17-16-12(3)20(14)18-13/h4-5,10-11H,6-9H2,1-3H3,(H,15,18)
InChIKeyWMKOEBPRIGDCRE-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.95
Rot. Bonds4

About 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine (PubChem CID 133294787) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine.

Molecular Properties

Compound Name3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
PubChem CID133294787
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
SMILESCc1nnc2ccc(NC(C)C(C)N3CCOCC3)nn12
InChIInChI=1S/C14H22N6O/c1-10(11(2)19-6-8-21-9-7-19)15-13-4-5-14-17-16-12(3)20(14)18-13/h4-5,10-11H,6-9H2,1-3H3,(H,15,18)
InChIKeyWMKOEBPRIGDCRE-UHFFFAOYSA-N
XLogP0.95
TPSA67.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclopropyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 133294788
N-methyl-6-(3-morpholin-4-ylbutan-2-ylamino)pyridazine-3-carboxamide
CID 133329435
4-methyl-2-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]pentan-1-ol
CID 71870907
N-(1-morpholin-4-ylpropan-2-yl)-3-thiophen-3-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 133489798
N-(2-morpholin-4-ylpropyl)-3-thiophen-3-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 133489519
3-methyl-N-[(3S)-oxan-3-yl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 95244110
3-methyl-N-[(4-piperidin-1-yloxan-4-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 71860376
N-[(2R)-2-morpholin-4-ylpropyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 32875134
N-[(1R)-1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 97059499
N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 51931109
3-(furan-2-yl)-3-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)amino]propan-1-ol
CID 133493815
3,6-dimethyl-N-(3-morpholin-4-ylbutan-2-yl)pyrazin-2-amine
CID 133470292

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The IUPAC name of 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine (CID 133294787) is 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine.
What is the SMILES notation for 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The canonical SMILES for 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine is Cc1nnc2ccc(NC(C)C(C)N3CCOCC3)nn12.
What is the InChIKey of 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
The InChIKey is WMKOEBPRIGDCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-10(11(2)19-6-8-21-9-7-19)15-13-4-5-14-17-16-12(3)20(14)18-13/h4-5,10-11H,6-9H2,1-3H3,(H,15,18).
What are the key properties of 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine?
3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine has a molecular weight of 290.37 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-morpholin-4-ylbutan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine is sourced from PubChem (CID 133294787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).