N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide

C75H75FN22O6 — CID 165020113

IUPACN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide
SMILESCn1cc(-c2cc3ncc(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)n3cn2)cn1.Cn1cc(-c2cnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnc3c2)cn1.Cn1cc(Nc2ccnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)cnc23)cn1
InChIInChI=1S/C25H24FN7O2.C25H26N8O2.C25H25N7O2/c1-25(2,3)21-10-22(31-35-21)30-24(34)9-15-5-6-16(7-19(15)26)20-13-27-23-8-17(11-29-33(20)23)18-12-28-32(4)14-18;1-25(2,3)21-12-22(31-35-21)30-23(34)11-16-5-7-17(8-6-16)20-14-26-24-19(9-10-27-33(20)24)29-18-13-28-32(4)15-18;1-25(2,3)21-11-22(30-34-21)29-24(33)9-16-5-7-17(8-6-16)20-13-26-23-10-19(27-15-32(20)23)18-12-28-31(4)14-18/h5-8,10-14H,9H2,1-4H3,(H,30,31,34);5-10,12-15,29H,11H2,1-4H3,(H,30,31,34);5-8,10-15H,9H2,1-4H3,(H,29,30,33)
InChIKeyLAMICXQPASUHAR-UHFFFAOYSA-N
MW1399.57 g/mol
LogP13.01
Rot. Bonds16

About N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide

N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide (PubChem CID 165020113) has the molecular formula C75H75FN22O6 and a molecular weight of 1399.57 g/mol. Its IUPAC name is N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide
PubChem CID165020113
Molecular FormulaC75H75FN22O6
Molecular Weight1399.57 g/mol
Exact Mass1398.62
IUPAC NameN-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide
SMILESCn1cc(-c2cc3ncc(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)n3cn2)cn1.Cn1cc(-c2cnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnc3c2)cn1.Cn1cc(Nc2ccnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)cnc23)cn1
InChIInChI=1S/C25H24FN7O2.C25H26N8O2.C25H25N7O2/c1-25(2,3)21-10-22(31-35-21)30-24(34)9-15-5-6-16(7-19(15)26)20-13-27-23-8-17(11-29-33(20)23)18-12-28-32(4)14-18;1-25(2,3)21-12-22(31-35-21)30-23(34)11-16-5-7-17(8-6-16)20-14-26-24-19(9-10-27-33(20)24)29-18-13-28-32(4)15-18;1-25(2,3)21-11-22(30-34-21)29-24(33)9-16-5-7-17(8-6-16)20-13-26-23-10-19(27-15-32(20)23)18-12-28-31(4)14-18/h5-8,10-14H,9H2,1-4H3,(H,30,31,34);5-10,12-15,29H,11H2,1-4H3,(H,30,31,34);5-8,10-15H,9H2,1-4H3,(H,29,30,33)
InChIKeyLAMICXQPASUHAR-UHFFFAOYSA-N
XLogP13.01
TPSA321.45 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds16
Heavy Atoms104
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001399.57
LogP ≤ 513.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Analyze N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide?
The IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide (CID 165020113) is N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide.
What is the SMILES notation for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide?
The canonical SMILES for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide is Cn1cc(-c2cc3ncc(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)n3cn2)cn1.Cn1cc(-c2cnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)c(F)c4)cnc3c2)cn1.Cn1cc(Nc2ccnn3c(-c4ccc(CC(=O)Nc5cc(C(C)(C)C)on5)cc4)cnc23)cn1.
What is the InChIKey of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide?
The InChIKey is LAMICXQPASUHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN7O2.C25H26N8O2.C25H25N7O2/c1-25(2,3)21-10-22(31-35-21)30-24(34)9-15-5-6-16(7-19(15)26)20-13-27-23-8-17(11-29-33(20)23)18-12-28-32(4)14-18;1-25(2,3)21-12-22(31-35-21)30-23(34)11-16-5-7-17(8-6-16)20-14-26-24-19(9-10-27-33(20)24)29-18-13-28-32(4)15-18;1-25(2,3)21-11-22(30-34-21)29-24(33)9-16-5-7-17(8-6-16)20-13-26-23-10-19(27-15-32(20)23)18-12-28-31(4)14-18/h5-8,10-14H,9H2,1-4H3,(H,30,31,34);5-10,12-15,29H,11H2,1-4H3,(H,30,31,34);5-8,10-15H,9H2,1-4H3,(H,29,30,33).
What are the key properties of N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide?
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide has a molecular weight of 1399.57 g/mol, XLogP of 13.01, 16 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[2-fluoro-4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[8-[(1-methylpyrazol-4-yl)amino]imidazo[1,2-b]pyridazin-3-yl]phenyl]acetamide;N-(5-tert-butyl-1,2-oxazol-3-yl)-2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-3-yl]phenyl]acetamide is sourced from PubChem (CID 165020113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).