[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol

C15H15N3O — CID 135217476

IUPAC[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
SMILESCc1ccc2nc(C)c(-c3ccc(CO)cc3)n2n1
InChIInChI=1S/C15H15N3O/c1-10-3-8-14-16-11(2)15(18(14)17-10)13-6-4-12(9-19)5-7-13/h3-8,19H,9H2,1-2H3
InChIKeyNKGYDESNZOZACZ-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.51
Rot. Bonds2

About [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol

[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol (PubChem CID 135217476) has the molecular formula C15H15N3O and a molecular weight of 253.30 g/mol. Its IUPAC name is [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
PubChem CID135217476
Molecular FormulaC15H15N3O
Molecular Weight253.30 g/mol
Exact Mass253.12
IUPAC Name[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
SMILESCc1ccc2nc(C)c(-c3ccc(CO)cc3)n2n1
InChIInChI=1S/C15H15N3O/c1-10-3-8-14-16-11(2)15(18(14)17-10)13-6-4-12(9-19)5-7-13/h3-8,19H,9H2,1-2H3
InChIKeyNKGYDESNZOZACZ-UHFFFAOYSA-N
XLogP2.51
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The IUPAC name of [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol (CID 135217476) is [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol.
What is the SMILES notation for [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The canonical SMILES for [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol is Cc1ccc2nc(C)c(-c3ccc(CO)cc3)n2n1.
What is the InChIKey of [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The InChIKey is NKGYDESNZOZACZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-10-3-8-14-16-11(2)15(18(14)17-10)13-6-4-12(9-19)5-7-13/h3-8,19H,9H2,1-2H3.
What are the key properties of [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
[4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol has a molecular weight of 253.30 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,6-dimethylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol is sourced from PubChem (CID 135217476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).