1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone

C18H24N6O2 — CID 91830679

IUPAC1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(C(=O)N2CCN(c3ccc4nccn4n3)CC2)CC1
InChIInChI=1S/C18H24N6O2/c1-14(25)21-7-4-15(5-8-21)18(26)23-12-10-22(11-13-23)17-3-2-16-19-6-9-24(16)20-17/h2-3,6,9,15H,4-5,7-8,10-13H2,1H3
InChIKeyQEBXNNYTDJNMAX-UHFFFAOYSA-N
MW356.43 g/mol
LogP0.64
Rot. Bonds2

About 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone

1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone (PubChem CID 91830679) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
PubChem CID91830679
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC Name1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(C(=O)N2CCN(c3ccc4nccn4n3)CC2)CC1
InChIInChI=1S/C18H24N6O2/c1-14(25)21-7-4-15(5-8-21)18(26)23-12-10-22(11-13-23)17-3-2-16-19-6-9-24(16)20-17/h2-3,6,9,15H,4-5,7-8,10-13H2,1H3
InChIKeyQEBXNNYTDJNMAX-UHFFFAOYSA-N
XLogP0.64
TPSA74.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

formic acid;4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)-1-methylpyrrolidin-2-one
CID 154904776
(5S)-5-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)-1-(2-methoxyethyl)piperidin-2-one
CID 126431316
5-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)-1-(2-methoxyethyl)piperidin-2-one
CID 119062976
1-imidazo[1,2-b]pyridazin-6-ylpiperidin-4-ol
CID 131704101
1-imidazo[1,2-b]pyridazin-6-yl-N,N-dimethylpyrrolidine-3-carboxamide
CID 126857228
1-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)-3-(1-methylpiperidin-4-yl)propan-1-one
CID 119068341
6-piperidin-1-ylimidazo[1,2-b]pyridazine
CID 23657730
6-[4-(1-acetylpiperidine-4-carbonyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 75461915
(2S)-1-(azepan-1-yl)-2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)propan-1-one
CID 125157813
(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)-(1,2,5-trimethylpyrrol-3-yl)methanone
CID 90653625
1-[4-[1-(6-pyrazol-1-ylpyridazin-3-yl)piperidine-4-carbonyl]piperazin-1-yl]ethanone
CID 90514137
[1-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 46326690

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone (CID 91830679) is 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone is CC(=O)N1CCC(C(=O)N2CCN(c3ccc4nccn4n3)CC2)CC1.
What is the InChIKey of 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone?
The InChIKey is QEBXNNYTDJNMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-14(25)21-7-4-15(5-8-21)18(26)23-12-10-22(11-13-23)17-3-2-16-19-6-9-24(16)20-17/h2-3,6,9,15H,4-5,7-8,10-13H2,1H3.
What are the key properties of 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone?
1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone has a molecular weight of 356.43 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-imidazo[1,2-b]pyridazin-6-ylpiperazine-1-carbonyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 91830679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).