2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide

C18H19N5O3 — CID 126938763

IUPAC2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2c(C)nc3ccccn23)n1
InChIInChI=1S/C18H19N5O3/c1-11-6-7-16(24)23(21-11)14-10-26-9-13(14)20-18(25)17-12(2)19-15-5-3-4-8-22(15)17/h3-8,13-14H,9-10H2,1-2H3,(H,20,25)
InChIKeyUMLKPMNLDCCLMK-UHFFFAOYSA-N
MW353.38 g/mol
LogP0.88
Rot. Bonds3

About 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 126938763) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID126938763
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC Name2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2c(C)nc3ccccn23)n1
InChIInChI=1S/C18H19N5O3/c1-11-6-7-16(24)23(21-11)14-10-26-9-13(14)20-18(25)17-12(2)19-15-5-3-4-8-22(15)17/h3-8,13-14H,9-10H2,1-2H3,(H,20,25)
InChIKeyUMLKPMNLDCCLMK-UHFFFAOYSA-N
XLogP0.88
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 126938763) is 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(=O)n(C2COCC2NC(=O)c2c(C)nc3ccccn23)n1.
What is the InChIKey of 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is UMLKPMNLDCCLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-11-6-7-16(24)23(21-11)14-10-26-9-13(14)20-18(25)17-12(2)19-15-5-3-4-8-22(15)17/h3-8,13-14H,9-10H2,1-2H3,(H,20,25).
What are the key properties of 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 126938763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).