2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine

C18H17N5O — CID 118288258

IUPAC2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1cn2nc(OCc3nc(-c4ccccc4)cn3C)ccc2n1
InChIInChI=1S/C18H17N5O/c1-13-10-23-16(19-13)8-9-18(21-23)24-12-17-20-15(11-22(17)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeySHDFNAJLHSGXKE-UHFFFAOYSA-N
MW319.37 g/mol
LogP3.02
Rot. Bonds4

About 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine

2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine (PubChem CID 118288258) has the molecular formula C18H17N5O and a molecular weight of 319.37 g/mol. Its IUPAC name is 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine
PubChem CID118288258
Molecular FormulaC18H17N5O
Molecular Weight319.37 g/mol
Exact Mass319.14
IUPAC Name2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1cn2nc(OCc3nc(-c4ccccc4)cn3C)ccc2n1
InChIInChI=1S/C18H17N5O/c1-13-10-23-16(19-13)8-9-18(21-23)24-12-17-20-15(11-22(17)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeySHDFNAJLHSGXKE-UHFFFAOYSA-N
XLogP3.02
TPSA57.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine?
The IUPAC name of 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine (CID 118288258) is 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine?
The canonical SMILES for 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine is Cc1cn2nc(OCc3nc(-c4ccccc4)cn3C)ccc2n1.
What is the InChIKey of 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine?
The InChIKey is SHDFNAJLHSGXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O/c1-13-10-23-16(19-13)8-9-18(21-23)24-12-17-20-15(11-22(17)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3.
What are the key properties of 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine?
2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine has a molecular weight of 319.37 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[(1-methyl-4-phenylimidazol-2-yl)methoxy]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 118288258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).