4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide

C146H171N23O12S8 — CID 158994108

About 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide

4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide (PubChem CID 158994108) has the molecular formula C146H171N23O12S8 and a molecular weight of 2696.66 g/mol. Its IUPAC name is 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide.

Molecular Properties

• Compound Name: 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide
• PubChem CID: 158994108
• Molecular Formula: C146H171N23O12S8
• Molecular Weight: 2696.66 g/mol
• Exact Mass: 2694.12
• IUPAC Name: 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide
• SMILES: CC(C)Oc1ccc(C(N)=O)cc1Nc1nc(-c2ccc(C3=CCN(C(C)C)CC3)cc2)cs1.CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C3CCN(C)CC3)cc2)cs1.CCN1CC=C(c2ccc(-c3csc(Nc4cc(C(N)=O)ccc4OC(C)C)n3)cc2)CC1.CCN1CCC(c2ccc(-c3csc(Nc4cc(S(N)(=O)=O)ccc4OC(C)C)n3)cc2)CC1.CCOc1ccncc1Nc1nc(-c2ccc(C3=CCCCC3)cc2)cs1.CCOc1ccncc1Nc1nc(-c2ccc(C3=CCN(C)CC3)cc2)cs1
• InChI: InChI=1S/C27H32N4O2S.C26H30N4O2S.C25H32N4O3S2.C24H30N4O3S2.C22H24N4OS.C22H23N3OS/c1-17(2)31-13-11-20(12-14-31)19-5-7-21(8-6-19)24-16-34-27(30-24)29-23-15-22(26(28)32)9-10-25(23)33-18(3)4;1-4-30-13-11-19(12-14-30)18-5-7-20(8-6-18)23-16-33-26(29-23)28-22-15-21(25(27)31)9-10-24(22)32-17(2)3;1-4-29-13-11-19(12-14-29)18-5-7-20(8-6-18)23-16-33-25(28-23)27-22-15-21(34(26,30)31)9-10-24(22)32-17(2)3;1-16(2)31-23-9-8-20(33(25,29)30)14-21(23)26-24-27-22(15-32-24)19-6-4-17(5-7-19)18-10-12-28(3)13-11-18;1-3-27-21-8-11-23-14-19(21)24-22-25-20(15-28-22)18-6-4-16(5-7-18)17-9-12-26(2)13-10-17;1-2-26-21-12-13-23-14-19(21)24-22-25-20(15-27-22)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h5-11,15-18H,12-14H2,1-4H3,(H2,28,32)(H,29,30);5-11,15-17H,4,12-14H2,1-3H3,(H2,27,31)(H,28,29);5-10,15-17,19H,4,11-14H2,1-3H3,(H,27,28)(H2,26,30,31);4-9,14-16,18H,10-13H2,1-3H3,(H,26,27)(H2,25,29,30);4-9,11,14-15H,3,10,12-13H2,1-2H3,(H,24,25);6,8-15H,2-5,7H2,1H3,(H,24,25)
• InChIKey: JQNIIROVWAYUIS-UHFFFAOYSA-N
• XLogP: 32.84
• TPSA: 453.38 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 37
• Rotatable Bonds: 43
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2696.66
LogP ≤ 5	32.84
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide?

The IUPAC name of 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide (CID 158994108) is 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide.

What is the SMILES notation for 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide?

The canonical SMILES for 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide is CC(C)Oc1ccc(C(N)=O)cc1Nc1nc(-c2ccc(C3=CCN(C(C)C)CC3)cc2)cs1.CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C3CCN(C)CC3)cc2)cs1.CCN1CC=C(c2ccc(-c3csc(Nc4cc(C(N)=O)ccc4OC(C)C)n3)cc2)CC1.CCN1CCC(c2ccc(-c3csc(Nc4cc(S(N)(=O)=O)ccc4OC(C)C)n3)cc2)CC1.CCOc1ccncc1Nc1nc(-c2ccc(C3=CCCCC3)cc2)cs1.CCOc1ccncc1Nc1nc(-c2ccc(C3=CCN(C)CC3)cc2)cs1.

What is the InChIKey of 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide?

The InChIKey is JQNIIROVWAYUIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N4O2S.C26H30N4O2S.C25H32N4O3S2.C24H30N4O3S2.C22H24N4OS.C22H23N3OS/c1-17(2)31-13-11-20(12-14-31)19-5-7-21(8-6-19)24-16-34-27(30-24)29-23-15-22(26(28)32)9-10-25(23)33-18(3)4;1-4-30-13-11-19(12-14-30)18-5-7-20(8-6-18)23-16-33-26(29-23)28-22-15-21(25(27)31)9-10-24(22)32-17(2)3;1-4-29-13-11-19(12-14-29)18-5-7-20(8-6-18)23-16-33-25(28-23)27-22-15-21(34(26,30)31)9-10-24(22)32-17(2)3;1-16(2)31-23-9-8-20(33(25,29)30)14-21(23)26-24-27-22(15-32-24)19-6-4-17(5-7-19)18-10-12-28(3)13-11-18;1-3-27-21-8-11-23-14-19(21)24-22-25-20(15-28-22)18-6-4-16(5-7-18)17-9-12-26(2)13-10-17;1-2-26-21-12-13-23-14-19(21)24-22-25-20(15-27-22)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h5-11,15-18H,12-14H2,1-4H3,(H2,28,32)(H,29,30);5-11,15-17H,4,12-14H2,1-3H3,(H2,27,31)(H,28,29);5-10,15-17,19H,4,11-14H2,1-3H3,(H,27,28)(H2,26,30,31);4-9,14-16,18H,10-13H2,1-3H3,(H,26,27)(H2,25,29,30);4-9,11,14-15H,3,10,12-13H2,1-2H3,(H,24,25);6,8-15H,2-5,7H2,1H3,(H,24,25).

What are the key properties of 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide?

4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide has a molecular weight of 2696.66 g/mol, XLogP of 32.84, 43 rotatable bonds, 10 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(cyclohexen-1-yl)phenyl]-N-(4-ethoxy-3-pyridinyl)-1,3-thiazol-2-amine;N-(4-ethoxy-3-pyridinyl)-4-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-amine;3-[[4-[4-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide;3-[[4-[4-(1-ethylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-methylpiperidin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[4-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)phenyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzamide is sourced from PubChem (CID 158994108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).