[6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone

C78H107N15O11 — CID 158060649

About [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone

[6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone (PubChem CID 158060649) has the molecular formula C78H107N15O11 and a molecular weight of 1430.81 g/mol. Its IUPAC name is [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone.

Molecular Properties

• Compound Name: [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone
• PubChem CID: 158060649
• Molecular Formula: C78H107N15O11
• Molecular Weight: 1430.81 g/mol
• Exact Mass: 1429.83
• IUPAC Name: [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone
• SMILES: CC(C)c1cc(C2=CCCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12.CC(C)c1cc(C2=CCOCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12.CC(C)c1cc(C2CCOCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12
• InChI: InChI=1S/C26H37N5O4.C26H35N5O4.C26H35N5O3/c2*1-17(2)19-14-20(18-6-12-35-13-7-18)28-31-15-21(27-22(19)31)23(32)30-11-10-29(16-25(30,3)4)24(33)26(34)8-5-9-26;1-17(2)19-14-20(18-8-5-6-9-18)28-31-15-21(27-22(19)31)23(32)30-13-12-29(16-25(30,3)4)24(33)26(34)10-7-11-26/h14-15,17-18,34H,5-13,16H2,1-4H3;6,14-15,17,34H,5,7-13,16H2,1-4H3;8,14-15,17,34H,5-7,9-13,16H2,1-4H3
• InChIKey: FKPDCAGDPQHBAT-UHFFFAOYSA-N
• XLogP: 8.76
• TPSA: 291.58 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 20
• Rotatable Bonds: 12
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1430.81
LogP ≤ 5	8.76
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone?

The IUPAC name of [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone (CID 158060649) is [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone.

What is the SMILES notation for [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone?

The canonical SMILES for [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone is CC(C)c1cc(C2=CCCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12.CC(C)c1cc(C2=CCOCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12.CC(C)c1cc(C2CCOCC2)nn2cc(C(=O)N3CCN(C(=O)C4(O)CCC4)CC3(C)C)nc12.

What is the InChIKey of [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone?

The InChIKey is FKPDCAGDPQHBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H37N5O4.C26H35N5O4.C26H35N5O3/c2*1-17(2)19-14-20(18-6-12-35-13-7-18)28-31-15-21(27-22(19)31)23(32)30-11-10-29(16-25(30,3)4)24(33)26(34)8-5-9-26;1-17(2)19-14-20(18-8-5-6-9-18)28-31-15-21(27-22(19)31)23(32)30-13-12-29(16-25(30,3)4)24(33)26(34)10-7-11-26/h14-15,17-18,34H,5-13,16H2,1-4H3;6,14-15,17,34H,5,7-13,16H2,1-4H3;8,14-15,17,34H,5-7,9-13,16H2,1-4H3.

What are the key properties of [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone?

[6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone has a molecular weight of 1430.81 g/mol, XLogP of 8.76, 12 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for [6-(cyclopenten-1-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(3,6-dihydro-2H-pyran-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[4-(1-hydroxycyclobutanecarbonyl)-2,2-dimethylpiperazin-1-yl]-[6-(oxan-4-yl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]methanone is sourced from PubChem (CID 158060649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).