(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone

C20H23N5O2 — CID 53166458

IUPAC(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
SMILESCCOc1ccc2nc(C(=O)N3CCN(c4ccccc4C)CC3)cn2n1
InChIInChI=1S/C20H23N5O2/c1-3-27-19-9-8-18-21-16(14-25(18)22-19)20(26)24-12-10-23(11-13-24)17-7-5-4-6-15(17)2/h4-9,14H,3,10-13H2,1-2H3
InChIKeyGBADURXTJOKBBJ-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.40
Rot. Bonds4

About (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone

(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone (PubChem CID 53166458) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
PubChem CID53166458
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
SMILESCCOc1ccc2nc(C(=O)N3CCN(c4ccccc4C)CC3)cn2n1
InChIInChI=1S/C20H23N5O2/c1-3-27-19-9-8-18-21-16(14-25(18)22-19)20(26)24-12-10-23(11-13-24)17-7-5-4-6-15(17)2/h4-9,14H,3,10-13H2,1-2H3
InChIKeyGBADURXTJOKBBJ-UHFFFAOYSA-N
XLogP2.40
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(2,5-dimethylphenyl)piperazin-1-yl]-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)methanone
CID 53166436
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-methylimidazo[1,2-b]pyridazin-6-yl)methanone
CID 155798999
(6-chloroimidazo[1,2-b]pyridazin-2-yl)-[4-(2,5-dimethylphenyl)piperazin-1-yl]methanone
CID 87051170
(3-ethoxyphenyl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
CID 17249640
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-ethyl-5-methylpyrazol-3-yl)methanone
CID 110681721
[4-(2,5-dimethylphenyl)piperazin-1-yl]-imidazo[1,2-a]pyridin-2-ylmethanone
CID 87051259
ethyl 4-ethyl-2-methyl-6-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate
CID 42742594
[4-(2-methylphenyl)piperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 18147919
6-ethoxy-N-(3-methoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide
CID 87051064
(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 87050991
1-[2-methyl-4-(2-methylphenyl)piperazin-1-yl]-2-([1,2,4]triazolo[4,3-b]pyridazin-6-yloxy)ethanone
CID 70755407
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
CID 9152988

Frequently Asked Questions

What is the IUPAC name of (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone?
The IUPAC name of (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone (CID 53166458) is (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone.
What is the SMILES notation for (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone?
The canonical SMILES for (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone is CCOc1ccc2nc(C(=O)N3CCN(c4ccccc4C)CC3)cn2n1.
What is the InChIKey of (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone?
The InChIKey is GBADURXTJOKBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-3-27-19-9-8-18-21-16(14-25(18)22-19)20(26)24-12-10-23(11-13-24)17-7-5-4-6-15(17)2/h4-9,14H,3,10-13H2,1-2H3.
What are the key properties of (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone?
(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone has a molecular weight of 365.44 g/mol, XLogP of 2.40, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone is sourced from PubChem (CID 53166458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).