5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol

C24H32N6O — CID 153483461

IUPAC5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol
SMILESCN(c1ccc(-c2ccc(-c3nccn3C)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C24H32N6O/c1-23(2)14-17(15-24(3,4)28-23)30(6)21-10-9-19(26-27-21)18-8-7-16(13-20(18)31)22-25-11-12-29(22)5/h7-13,17,28,31H,14-15H2,1-6H3
InChIKeyDGSCUWAOESAHMJ-UHFFFAOYSA-N
MW420.56 g/mol
LogP4.00
Rot. Bonds4

About 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol

5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol (PubChem CID 153483461) has the molecular formula C24H32N6O and a molecular weight of 420.56 g/mol. Its IUPAC name is 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol.

Molecular Properties

Compound Name5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol
PubChem CID153483461
Molecular FormulaC24H32N6O
Molecular Weight420.56 g/mol
Exact Mass420.26
IUPAC Name5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol
SMILESCN(c1ccc(-c2ccc(-c3nccn3C)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C24H32N6O/c1-23(2)14-17(15-24(3,4)28-23)30(6)21-10-9-19(26-27-21)18-8-7-16(13-20(18)31)22-25-11-12-29(22)5/h7-13,17,28,31H,14-15H2,1-6H3
InChIKeyDGSCUWAOESAHMJ-UHFFFAOYSA-N
XLogP4.00
TPSA79.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.56
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol?
The IUPAC name of 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol (CID 153483461) is 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol.
What is the SMILES notation for 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol?
The canonical SMILES for 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol is CN(c1ccc(-c2ccc(-c3nccn3C)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol?
The InChIKey is DGSCUWAOESAHMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N6O/c1-23(2)14-17(15-24(3,4)28-23)30(6)21-10-9-19(26-27-21)18-8-7-16(13-20(18)31)22-25-11-12-29(22)5/h7-13,17,28,31H,14-15H2,1-6H3.
What are the key properties of 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol?
5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol has a molecular weight of 420.56 g/mol, XLogP of 4.00, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylimidazol-2-yl)-2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]phenol is sourced from PubChem (CID 153483461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).