[2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol

C169H146Cl9F3N24O6 — CID 158796217

About [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol

[2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol (PubChem CID 158796217) has the molecular formula C169H146Cl9F3N24O6 and a molecular weight of 2985.26 g/mol. Its IUPAC name is [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol.

Molecular Properties

• Compound Name: [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol
• PubChem CID: 158796217
• Molecular Formula: C169H146Cl9F3N24O6
• Molecular Weight: 2985.26 g/mol
• Exact Mass: 2978.90
• IUPAC Name: [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol
• SMILES: CCCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1c(-c2ccccc2)c(Cl)nc2ccc(C(O)(c3ccccn3)c3cncn3C)cc12.CN(C)c1nc2ccc(C(O)(c3ccncc3)c3ccccn3)cc2c(Cl)c1-c1ccccc1.CN1CCC(C(O)(c2cccnc2)c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)CC1.OC(c1cccc(Cl)c1)(c1ccnc(C(F)(F)F)c1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1
• InChI: InChI=1S/C30H30ClN5O.C29H28ClN5O.C28H16Cl3F3N2O.C28H23ClN4O.C27H25Cl2N3O.C27H24ClN5O/c1-4-5-17-35(2)29-27(21-9-7-6-8-10-21)28(31)24-18-23(11-12-25(24)34-29)30(37,22-13-15-32-16-14-22)26-19-33-20-36(26)3;1-4-16-34(2)28-26(20-8-6-5-7-9-20)27(30)23-17-22(10-11-24(23)33-28)29(36,21-12-14-31-15-13-21)25-18-32-19-35(25)3;29-20-8-4-7-17(13-20)27(37,19-11-12-35-23(15-19)28(32,33)34)18-9-10-22-21(14-18)25(30)24(26(31)36-22)16-5-2-1-3-6-16;1-33(2)27-25(19-8-4-3-5-9-19)26(29)22-18-21(11-12-23(22)32-27)28(34,20-13-16-30-17-14-20)24-10-6-7-15-31-24;1-32-14-11-19(12-15-32)27(33,21-8-5-13-30-17-21)20-9-10-23-22(16-20)25(28)24(26(29)31-23)18-6-3-2-4-7-18;1-32(2)25-20-15-19(12-13-21(20)31-26(28)24(25)18-9-5-4-6-10-18)27(34,22-11-7-8-14-30-22)23-16-29-17-33(23)3/h6-16,18-20,37H,4-5,17H2,1-3H3;5-15,17-19,36H,4,16H2,1-3H3;1-15,37H;3-18,34H,1-2H3;2-10,13,16-17,19,33H,11-12,14-15H2,1H3;4-17,34H,1-3H3
• InChIKey: ISWXQYSMSXGRBS-UHFFFAOYSA-N
• XLogP: 37.49
• TPSA: 358.61 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 33
• Heavy Atoms: 211
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2985.26
LogP ≤ 5	37.49
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol?

The IUPAC name of [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol (CID 158796217) is [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol.

What is the SMILES notation for [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol?

The canonical SMILES for [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol is CCCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CCCN(C)c1nc2ccc(C(O)(c3ccncc3)c3cncn3C)cc2c(Cl)c1-c1ccccc1.CN(C)c1c(-c2ccccc2)c(Cl)nc2ccc(C(O)(c3ccccn3)c3cncn3C)cc12.CN(C)c1nc2ccc(C(O)(c3ccncc3)c3ccccn3)cc2c(Cl)c1-c1ccccc1.CN1CCC(C(O)(c2cccnc2)c2ccc3nc(Cl)c(-c4ccccc4)c(Cl)c3c2)CC1.OC(c1cccc(Cl)c1)(c1ccnc(C(F)(F)F)c1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.

What is the InChIKey of [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol?

The InChIKey is ISWXQYSMSXGRBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30ClN5O.C29H28ClN5O.C28H16Cl3F3N2O.C28H23ClN4O.C27H25Cl2N3O.C27H24ClN5O/c1-4-5-17-35(2)29-27(21-9-7-6-8-10-21)28(31)24-18-23(11-12-25(24)34-29)30(37,22-13-15-32-16-14-22)26-19-33-20-36(26)3;1-4-16-34(2)28-26(20-8-6-5-7-9-20)27(30)23-17-22(10-11-24(23)33-28)29(36,21-12-14-31-15-13-21)25-18-32-19-35(25)3;29-20-8-4-7-17(13-20)27(37,19-11-12-35-23(15-19)28(32,33)34)18-9-10-22-21(14-18)25(30)24(26(31)36-22)16-5-2-1-3-6-16;1-33(2)27-25(19-8-4-3-5-9-19)26(29)22-18-21(11-12-23(22)32-27)28(34,20-13-16-30-17-14-20)24-10-6-7-15-31-24;1-32-14-11-19(12-15-32)27(33,21-8-5-13-30-17-21)20-9-10-23-22(16-20)25(28)24(26(29)31-23)18-6-3-2-4-7-18;1-32(2)25-20-15-19(12-13-21(20)31-26(28)24(25)18-9-5-4-6-10-18)27(34,22-11-7-8-14-30-22)23-16-29-17-33(23)3/h6-16,18-20,37H,4-5,17H2,1-3H3;5-15,17-19,36H,4,16H2,1-3H3;1-15,37H;3-18,34H,1-2H3;2-10,13,16-17,19,33H,11-12,14-15H2,1H3;4-17,34H,1-3H3.

What are the key properties of [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol?

[2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol has a molecular weight of 2985.26 g/mol, XLogP of 37.49, 33 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[butyl(methyl)amino]-4-chloro-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-2-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-pyridin-2-yl-pyridin-4-ylmethanol;[4-chloro-2-[methyl(propyl)amino]-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(1-methylpiperidin-4-yl)-pyridin-3-ylmethanol is sourced from PubChem (CID 158796217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).