2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine

C18H18N6O — CID 118288234

IUPAC2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(OCc3nc(-c4ccccc4)nn3C)nn2c1C
InChIInChI=1S/C18H18N6O/c1-12-13(2)24-15(19-12)9-10-17(21-24)25-11-16-20-18(22-23(16)3)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3
InChIKeyOVLLQBXUWGOCIK-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.72
Rot. Bonds4

About 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine

2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine (PubChem CID 118288234) has the molecular formula C18H18N6O and a molecular weight of 334.38 g/mol. Its IUPAC name is 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine
PubChem CID118288234
Molecular FormulaC18H18N6O
Molecular Weight334.38 g/mol
Exact Mass334.15
IUPAC Name2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(OCc3nc(-c4ccccc4)nn3C)nn2c1C
InChIInChI=1S/C18H18N6O/c1-12-13(2)24-15(19-12)9-10-17(21-24)25-11-16-20-18(22-23(16)3)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3
InChIKeyOVLLQBXUWGOCIK-UHFFFAOYSA-N
XLogP2.72
TPSA70.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine?
The IUPAC name of 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine (CID 118288234) is 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine?
The canonical SMILES for 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine is Cc1nc2ccc(OCc3nc(-c4ccccc4)nn3C)nn2c1C.
What is the InChIKey of 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine?
The InChIKey is OVLLQBXUWGOCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O/c1-12-13(2)24-15(19-12)9-10-17(21-24)25-11-16-20-18(22-23(16)3)14-7-5-4-6-8-14/h4-10H,11H2,1-3H3.
What are the key properties of 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine?
2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine has a molecular weight of 334.38 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-[(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 118288234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).