3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide

C21H19N5O2 — CID 154565546

IUPAC3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)nc2ccccn12
InChIInChI=1S/C21H19N5O2/c1-15-20(23-18-9-5-6-13-25(15)18)21(28)22-12-14-26-19(27)11-10-17(24-26)16-7-3-2-4-8-16/h2-11,13H,12,14H2,1H3,(H,22,28)
InChIKeyJOLXSDCNRZURMH-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.30
Rot. Bonds5

About 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide

3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 154565546) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID154565546
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC Name3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)nc2ccccn12
InChIInChI=1S/C21H19N5O2/c1-15-20(23-18-9-5-6-13-25(15)18)21(28)22-12-14-26-19(27)11-10-17(24-26)16-7-3-2-4-8-16/h2-11,13H,12,14H2,1H3,(H,22,28)
InChIKeyJOLXSDCNRZURMH-UHFFFAOYSA-N
XLogP2.30
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,5-dimethyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]benzamide
CID 18569617
N-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 122277985
2-(3-methyl-6-oxopyridazin-1-yl)-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide
CID 121033306
2-ethyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]pyrimidine-5-carboxamide
CID 72931856
1-benzyl-6-oxo-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]pyridazine-3-carboxamide
CID 121033347
N-[2-oxo-2-[2-(6-oxo-3-phenylpyridazin-1-yl)ethylamino]ethyl]benzamide
CID 121033287
2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide
CID 121050358
N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]-2-phenoxybenzamide
CID 121033316
3,4-diethoxy-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]benzamide
CID 41240868
1-benzyl-3-[2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]ethyl]urea
CID 42109840
8-methoxy-2-oxo-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]chromene-3-carboxamide
CID 121033378
2-[4-(methylamino)butyl]-6-phenylpyridazin-3-one
CID 13103478

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 154565546) is 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1c(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)nc2ccccn12.
What is the InChIKey of 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is JOLXSDCNRZURMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-15-20(23-18-9-5-6-13-25(15)18)21(28)22-12-14-26-19(27)11-10-17(24-26)16-7-3-2-4-8-16/h2-11,13H,12,14H2,1H3,(H,22,28).
What are the key properties of 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide?
3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 154565546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).