N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)

C70H94Cl7I2N25O5 — CID 160879471

About N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)

N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide) (PubChem CID 160879471) has the molecular formula C70H94Cl7I2N25O5 and a molecular weight of 1867.67 g/mol. Its IUPAC name is N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide).

Molecular Properties

• Compound Name: N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)
• PubChem CID: 160879471
• Molecular Formula: C70H94Cl7I2N25O5
• Molecular Weight: 1867.67 g/mol
• Exact Mass: 1863.38
• IUPAC Name: N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)
• SMILES: CC.CC(=O)N[C@@H]1CCN(c2cc(C)nn3c(I)c(C)nc23)C1.CC(=O)N[C@@H]1CCN(c2cc(C)nn3cc(C)nc23)C1.CC(=O)N[C@@H]1CCN(c2cc(Cl)nn3cc(C)nc23)C1.CC(=O)N[C@@H]1CCNC1.CC(=O)N[C@@H]1CCNC1.Cc1cn2nc(Cl)cc(Cl)c2n1.Cc1nc2c(Cl)cc(Cl)nn2c1I.ClCCl
• InChI: InChI=1S/C14H18IN5O.C14H19N5O.C13H16ClN5O.C7H4Cl2IN3.C7H5Cl2N3.2C6H12N2O.C2H6.CH2Cl2/c1-8-6-12(14-16-9(2)13(15)20(14)18-8)19-5-4-11(7-19)17-10(3)21;1-9-6-13(14-15-10(2)7-19(14)17-9)18-5-4-12(8-18)16-11(3)20;1-8-6-19-13(15-8)11(5-12(14)17-19)18-4-3-10(7-18)16-9(2)20;1-3-6(10)13-7(11-3)4(8)2-5(9)12-13;1-4-3-12-7(10-4)5(8)2-6(9)11-12;2*1-5(9)8-6-2-3-7-4-6;1-2;2-1-3/h6,11H,4-5,7H2,1-3H3,(H,17,21);6-7,12H,4-5,8H2,1-3H3,(H,16,20);5-6,10H,3-4,7H2,1-2H3,(H,16,20);2H,1H3;2-3H,1H3;2*6-7H,2-4H2,1H3,(H,8,9);1-2H3;1H2/t11-;12-;10-;;;2*6-;;/m111..11../s1
• InChIKey: SMVPJQUVFGWIFT-QWLAOUGKSA-N
• XLogP: 10.84
• TPSA: 330.23 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 25
• Rotatable Bonds: 8
• Heavy Atoms: 109
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1867.67
LogP ≤ 5	10.84
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)?

The IUPAC name of N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide) (CID 160879471) is N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide).

What is the SMILES notation for N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)?

The canonical SMILES for N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide) is CC.CC(=O)N[C@@H]1CCN(c2cc(C)nn3c(I)c(C)nc23)C1.CC(=O)N[C@@H]1CCN(c2cc(C)nn3cc(C)nc23)C1.CC(=O)N[C@@H]1CCN(c2cc(Cl)nn3cc(C)nc23)C1.CC(=O)N[C@@H]1CCNC1.CC(=O)N[C@@H]1CCNC1.Cc1cn2nc(Cl)cc(Cl)c2n1.Cc1nc2c(Cl)cc(Cl)nn2c1I.ClCCl.

What is the InChIKey of N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)?

The InChIKey is SMVPJQUVFGWIFT-QWLAOUGKSA-N. The full InChI is InChI=1S/C14H18IN5O.C14H19N5O.C13H16ClN5O.C7H4Cl2IN3.C7H5Cl2N3.2C6H12N2O.C2H6.CH2Cl2/c1-8-6-12(14-16-9(2)13(15)20(14)18-8)19-5-4-11(7-19)17-10(3)21;1-9-6-13(14-15-10(2)7-19(14)17-9)18-5-4-12(8-18)16-11(3)20;1-8-6-19-13(15-8)11(5-12(14)17-19)18-4-3-10(7-18)16-9(2)20;1-3-6(10)13-7(11-3)4(8)2-5(9)12-13;1-4-3-12-7(10-4)5(8)2-6(9)11-12;2*1-5(9)8-6-2-3-7-4-6;1-2;2-1-3/h6,11H,4-5,7H2,1-3H3,(H,17,21);6-7,12H,4-5,8H2,1-3H3,(H,16,20);5-6,10H,3-4,7H2,1-2H3,(H,16,20);2H,1H3;2-3H,1H3;2*6-7H,2-4H2,1H3,(H,8,9);1-2H3;1H2/t11-;12-;10-;;;2*6-;;/m111..11../s1.

What are the key properties of N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide)?

N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide) has a molecular weight of 1867.67 g/mol, XLogP of 10.84, 8 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3R)-1-(6-chloro-2-methylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;6,8-dichloro-3-iodo-2-methylimidazo[1,2-b]pyridazine;dichloromethane;6,8-dichloro-2-methylimidazo[1,2-b]pyridazine;N-[(3R)-1-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;ethane;N-[(3R)-1-(3-iodo-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide;bis(N-[(3R)-pyrrolidin-3-yl]acetamide) is sourced from PubChem (CID 160879471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).