4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone

C117H157N19O14S5 — CID 158705314

About 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone

4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone (PubChem CID 158705314) has the molecular formula C117H157N19O14S5 and a molecular weight of 2214.00 g/mol. Its IUPAC name is 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone.

Molecular Properties

• Compound Name: 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone
• PubChem CID: 158705314
• Molecular Formula: C117H157N19O14S5
• Molecular Weight: 2214.00 g/mol
• Exact Mass: 2212.08
• IUPAC Name: 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone
• SMILES: CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(=O)N(C)C)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(=O)N4CCOCC4)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)N)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)O)cc3n2)cs1.CCNCCOc1ccc2c(OC(C)(C)C)cc(-c3csc(NC(C)C)n3)nc2c1
• InChI: InChI=1S/C25H32N4O4S.C23H30N4O3S.2C23H32N4O2S.C23H31N3O3S/c1-16(2)26-24-28-21(15-34-24)20-13-22(33-25(3,4)5)18-7-6-17(12-19(18)27-20)32-14-23(30)29-8-10-31-11-9-29;1-14(2)24-22-26-19(13-31-22)18-11-20(30-23(3,4)5)16-9-8-15(10-17(16)25-18)29-12-21(28)27(6)7;1-14(2)25-21-27-19(12-30-21)18-11-20(29-22(3,4)5)16-9-8-15(10-17(16)26-18)28-13-23(6,7)24;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;1-14(2)24-21-26-19(12-30-21)18-11-20(29-22(3,4)5)16-9-8-15(10-17(16)25-18)28-13-23(6,7)27/h6-7,12-13,15-16H,8-11,14H2,1-5H3,(H,26,28);8-11,13-14H,12H2,1-7H3,(H,24,26);8-12,14H,13,24H2,1-7H3,(H,25,27);8-9,12-15,24H,7,10-11H2,1-6H3,(H,25,27);8-12,14,27H,13H2,1-7H3,(H,24,26)
• InChIKey: IIARIVXWZJNPNB-UHFFFAOYSA-N
• XLogP: 25.74
• TPSA: 389.48 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 36
• Rotatable Bonds: 37
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2214.00
LogP ≤ 5	25.74
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	36

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)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone?

The IUPAC name of 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone (CID 158705314) is 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone.

What is the SMILES notation for 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone?

The canonical SMILES for 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone is CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(=O)N(C)C)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(=O)N4CCOCC4)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)N)cc3n2)cs1.CC(C)Nc1nc(-c2cc(OC(C)(C)C)c3ccc(OCC(C)(C)O)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)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone?

The InChIKey is IIARIVXWZJNPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N4O4S.C23H30N4O3S.2C23H32N4O2S.C23H31N3O3S/c1-16(2)26-24-28-21(15-34-24)20-13-22(33-25(3,4)5)18-7-6-17(12-19(18)27-20)32-14-23(30)29-8-10-31-11-9-29;1-14(2)24-22-26-19(13-31-22)18-11-20(30-23(3,4)5)16-9-8-15(10-17(16)25-18)29-12-21(28)27(6)7;1-14(2)25-21-27-19(12-30-21)18-11-20(29-22(3,4)5)16-9-8-15(10-17(16)26-18)28-13-23(6,7)24;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;1-14(2)24-21-26-19(12-30-21)18-11-20(29-22(3,4)5)16-9-8-15(10-17(16)25-18)28-13-23(6,7)27/h6-7,12-13,15-16H,8-11,14H2,1-5H3,(H,26,28);8-11,13-14H,12H2,1-7H3,(H,24,26);8-12,14H,13,24H2,1-7H3,(H,25,27);8-9,12-15,24H,7,10-11H2,1-6H3,(H,25,27);8-12,14,27H,13H2,1-7H3,(H,24,26).

What are the key properties of 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone?

4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone has a molecular weight of 2214.00 g/mol, XLogP of 25.74, 37 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[7-(2-amino-2-methylpropoxy)-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxyacetamide;4-[7-[2-(ethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine;2-methyl-1-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxypropan-2-ol;2-[4-[(2-methylpropan-2-yl)oxy]-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-7-yl]oxy-1-morpholin-4-ylethanone is sourced from PubChem (CID 158705314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).