4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine

C96H130Cl2N16O10S4 — CID 159276314

About 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine

4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 159276314) has the molecular formula C96H130Cl2N16O10S4 and a molecular weight of 1867.37 g/mol. Its IUPAC name is 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

• Compound Name: 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
• PubChem CID: 159276314
• Molecular Formula: C96H130Cl2N16O10S4
• Molecular Weight: 1867.37 g/mol
• Exact Mass: 1864.84
• IUPAC Name: 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
• SMILES: CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)N)c(Cl)c3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCCN4CCOCC4)c(Cl)c3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCCN4CCOCC4)cc3n2)cs1.CCNCCOc1ccc2c(OC(C)(C)C)cc(-c3csc(NC(C)C)n3)nc2c1
• InChI: InChI=1S/C25H33ClN4O3S.C25H34N4O3S.C23H31ClN4O2S.C23H32N4O2S/c1-16(2)27-24-29-19(15-34-24)18-14-21(33-25(3,4)5)17-6-7-20(22(26)23(17)28-18)32-13-10-30-8-11-31-12-9-30;1-17(2)26-24-28-22(16-33-24)21-15-23(32-25(3,4)5)19-7-6-18(14-20(19)27-21)31-13-10-29-8-11-30-12-9-29;1-13(2)26-21-28-16(11-31-21)15-10-18(30-22(3,4)5)14-8-9-17(19(24)20(14)27-15)29-12-23(6,7)25;1-7-24-10-11-28-16-8-9-17-18(12-16)26-19(13-21(17)29-23(4,5)6)20-14-30-22(27-20)25-15(2)3/h6-7,14-16H,8-13H2,1-5H3,(H,27,29);6-7,14-17H,8-13H2,1-5H3,(H,26,28);8-11,13H,12,25H2,1-7H3,(H,26,28);8-9,12-15,24H,7,10-11H2,1-6H3,(H,25,27)
• InChIKey: KYISWXGXAUKILX-UHFFFAOYSA-N
• XLogP: 22.26
• TPSA: 288.07 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 32
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1867.37
LogP ≤ 5	22.26
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine?

The IUPAC name of 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine (CID 159276314) is 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine.

What is the SMILES notation for 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine?

The canonical SMILES for 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine is CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)N)c(Cl)c3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCCN4CCOCC4)c(Cl)c3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCCN4CCOCC4)cc3n2)cs1.CCNCCOc1ccc2c(OC(C)(C)C)cc(-c3csc(NC(C)C)n3)nc2c1.

What is the InChIKey of 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine?

The InChIKey is KYISWXGXAUKILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33ClN4O3S.C25H34N4O3S.C23H31ClN4O2S.C23H32N4O2S/c1-16(2)27-24-29-19(15-34-24)18-14-21(33-25(3,4)5)17-6-7-20(22(26)23(17)28-18)32-13-10-30-8-11-31-12-9-30;1-17(2)26-24-28-22(16-33-24)21-15-23(32-25(3,4)5)19-7-6-18(14-20(19)27-21)31-13-10-29-8-11-30-12-9-29;1-13(2)26-21-28-16(11-31-21)15-10-18(30-22(3,4)5)14-8-9-17(19(24)20(14)27-15)29-12-23(6,7)25;1-7-24-10-11-28-16-8-9-17-18(12-16)26-19(13-21(17)29-23(4,5)6)20-14-30-22(27-20)25-15(2)3/h6-7,14-16H,8-13H2,1-5H3,(H,27,29);6-7,14-17H,8-13H2,1-5H3,(H,26,28);8-11,13H,12,25H2,1-7H3,(H,26,28);8-9,12-15,24H,7,10-11H2,1-6H3,(H,25,27).

What are the key properties of 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine?

4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 1867.37 g/mol, XLogP of 22.26, 32 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[7-(2-amino-2-methylpropoxy)-8-chloro-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[8-chloro-4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;4-[4-[(2-methylpropan-2-yl)oxy]-7-(2-morpholin-4-ylethoxy)quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 159276314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).