1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone

C19H30N6O2 — CID 57443047

IUPAC1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone
SMILESCOc1ccc(N2CCN(CC(=O)N3CCN(C4CCC4)CC3)CC2)nn1
InChIInChI=1S/C19H30N6O2/c1-27-18-6-5-17(20-21-18)24-9-7-22(8-10-24)15-19(26)25-13-11-23(12-14-25)16-3-2-4-16/h5-6,16H,2-4,7-15H2,1H3
InChIKeyBTUHVVTYRHJWKS-UHFFFAOYSA-N
MW374.49 g/mol
LogP0.30
Rot. Bonds5

About 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone

1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone (PubChem CID 57443047) has the molecular formula C19H30N6O2 and a molecular weight of 374.49 g/mol. Its IUPAC name is 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone
PubChem CID57443047
Molecular FormulaC19H30N6O2
Molecular Weight374.49 g/mol
Exact Mass374.24
IUPAC Name1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone
SMILESCOc1ccc(N2CCN(CC(=O)N3CCN(C4CCC4)CC3)CC2)nn1
InChIInChI=1S/C19H30N6O2/c1-27-18-6-5-17(20-21-18)24-9-7-22(8-10-24)15-19(26)25-13-11-23(12-14-25)16-3-2-4-16/h5-6,16H,2-4,7-15H2,1H3
InChIKeyBTUHVVTYRHJWKS-UHFFFAOYSA-N
XLogP0.30
TPSA65.04 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone with MolForge

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Related Compounds

ethyl 4-[6-[4-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl]pyridazin-3-yl]benzoate
CID 57443180
1-(4-cyclobutylpiperazin-1-yl)-2-[4-[6-(3-propan-2-ylphenyl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 57443060
1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-naphthalen-2-ylpyridazin-3-yl)piperazin-1-yl]ethanone
CID 57443053
1-(4-cyclobutylpiperazin-1-yl)-2-[4-[6-(2,3-dichlorophenyl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 57443097
1-(4-cyclobutylpiperazin-1-yl)-2-[4-[6-(2,5-dichlorophenyl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 57443103
2-[4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]piperazin-1-yl]-1-(4-cyclobutylpiperazin-1-yl)ethanone
CID 57443035
1-[4-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 57442725
1-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]butan-1-one
CID 16883280
1-(4-cyclobutylpiperazin-1-yl)-2-[4-[5-(piperidine-1-carbonyl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 58826231
2-[4-(4-acetylphenyl)piperazin-1-yl]-1-(4-cyclobutylpiperazin-1-yl)ethanone
CID 57442402
cyclopropyl-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]methanone
CID 16883287
1-(4-cyclobutylpiperazin-1-yl)-2-[4-[5-(2-methylpiperidine-1-carbonyl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 57442793

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone?
The IUPAC name of 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone (CID 57443047) is 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone is COc1ccc(N2CCN(CC(=O)N3CCN(C4CCC4)CC3)CC2)nn1.
What is the InChIKey of 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone?
The InChIKey is BTUHVVTYRHJWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6O2/c1-27-18-6-5-17(20-21-18)24-9-7-22(8-10-24)15-19(26)25-13-11-23(12-14-25)16-3-2-4-16/h5-6,16H,2-4,7-15H2,1H3.
What are the key properties of 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone?
1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone has a molecular weight of 374.49 g/mol, XLogP of 0.30, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclobutylpiperazin-1-yl)-2-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 57443047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).