N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide

C18H18N4O2 — CID 16824889

IUPACN-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide
SMILESCOc1ccc2nc(-c3ccc(C)c(NC(=O)C4CC4)c3)cn2n1
InChIInChI=1S/C18H18N4O2/c1-11-3-4-13(9-14(11)20-18(23)12-5-6-12)15-10-22-16(19-15)7-8-17(21-22)24-2/h3-4,7-10,12H,5-6H2,1-2H3,(H,20,23)
InChIKeyNIMTZUUONZGXHA-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.06
Rot. Bonds4

About N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide

N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide (PubChem CID 16824889) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide
PubChem CID16824889
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC NameN-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide
SMILESCOc1ccc2nc(-c3ccc(C)c(NC(=O)C4CC4)c3)cn2n1
InChIInChI=1S/C18H18N4O2/c1-11-3-4-13(9-14(11)20-18(23)12-5-6-12)15-10-22-16(19-15)7-8-17(21-22)24-2/h3-4,7-10,12H,5-6H2,1-2H3,(H,20,23)
InChIKeyNIMTZUUONZGXHA-UHFFFAOYSA-N
XLogP3.06
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide?
The IUPAC name of N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide (CID 16824889) is N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide is COc1ccc2nc(-c3ccc(C)c(NC(=O)C4CC4)c3)cn2n1.
What is the InChIKey of N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide?
The InChIKey is NIMTZUUONZGXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-11-3-4-13(9-14(11)20-18(23)12-5-6-12)15-10-22-16(19-15)7-8-17(21-22)24-2/h3-4,7-10,12H,5-6H2,1-2H3,(H,20,23).
What are the key properties of N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide?
N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide has a molecular weight of 322.37 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-2-methylphenyl]cyclopropanecarboxamide is sourced from PubChem (CID 16824889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).