8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine

C103H108Cl6N18O9 — CID 159851314

About 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine

8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine (PubChem CID 159851314) has the molecular formula C103H108Cl6N18O9 and a molecular weight of 1954.83 g/mol. Its IUPAC name is 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine.

Molecular Properties

• Compound Name: 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine
• PubChem CID: 159851314
• Molecular Formula: C103H108Cl6N18O9
• Molecular Weight: 1954.83 g/mol
• Exact Mass: 1950.67
• IUPAC Name: 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine
• SMILES: COc1cc(C)c(Cl)c(-c2ccc(C(=O)O)c3nc(C)c(C)nc23)c1Cl.COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCN(Cc5ccc(C)cc5)CC4)cn3)c3nc(C)c(C)nc23)c1Cl.COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCNCC4)cn3)c3nc(C)c(C)nc23)c1Cl.Cc1ccc(CN2CCN(Cc3ccc(N)nc3)CC2)cc1
• InChI: InChI=1S/C37H38Cl2N6O3.C29H30Cl2N6O3.C19H16Cl2N2O3.C18H24N4/c1-22-6-8-25(9-7-22)20-44-14-16-45(17-15-44)21-26-10-13-31(40-19-26)43-37(46)28-12-11-27(35-36(28)42-24(3)23(2)41-35)32-33(38)29(47-4)18-30(48-5)34(32)39;1-16-17(2)35-28-20(29(38)36-23-8-5-18(14-33-23)15-37-11-9-32-10-12-37)7-6-19(27(28)34-16)24-25(30)21(39-3)13-22(40-4)26(24)31;1-8-7-13(26-4)16(21)14(15(8)20)11-5-6-12(19(24)25)18-17(11)22-9(2)10(3)23-18;1-15-2-4-16(5-3-15)13-21-8-10-22(11-9-21)14-17-6-7-18(19)20-12-17/h6-13,18-19H,14-17,20-21H2,1-5H3,(H,40,43,46);5-8,13-14,32H,9-12,15H2,1-4H3,(H,33,36,38);5-7H,1-4H3,(H,24,25);2-7,12H,8-11,13-14H2,1H3,(H2,19,20)
• InChIKey: NPYZNCLAANPEAV-UHFFFAOYSA-N
• XLogP: 20.33
• TPSA: 311.91 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 23
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1954.83
LogP ≤ 5	20.33
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine?

The IUPAC name of 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine (CID 159851314) is 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine.

What is the SMILES notation for 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine?

The canonical SMILES for 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine is COc1cc(C)c(Cl)c(-c2ccc(C(=O)O)c3nc(C)c(C)nc23)c1Cl.COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCN(Cc5ccc(C)cc5)CC4)cn3)c3nc(C)c(C)nc23)c1Cl.COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCNCC4)cn3)c3nc(C)c(C)nc23)c1Cl.Cc1ccc(CN2CCN(Cc3ccc(N)nc3)CC2)cc1.

What is the InChIKey of 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine?

The InChIKey is NPYZNCLAANPEAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H38Cl2N6O3.C29H30Cl2N6O3.C19H16Cl2N2O3.C18H24N4/c1-22-6-8-25(9-7-22)20-44-14-16-45(17-15-44)21-26-10-13-31(40-19-26)43-37(46)28-12-11-27(35-36(28)42-24(3)23(2)41-35)32-33(38)29(47-4)18-30(48-5)34(32)39;1-16-17(2)35-28-20(29(38)36-23-8-5-18(14-33-23)15-37-11-9-32-10-12-37)7-6-19(27(28)34-16)24-25(30)21(39-3)13-22(40-4)26(24)31;1-8-7-13(26-4)16(21)14(15(8)20)11-5-6-12(19(24)25)18-17(11)22-9(2)10(3)23-18;1-15-2-4-16(5-3-15)13-21-8-10-22(11-9-21)14-17-6-7-18(19)20-12-17/h6-13,18-19H,14-17,20-21H2,1-5H3,(H,40,43,46);5-8,13-14,32H,9-12,15H2,1-4H3,(H,33,36,38);5-7H,1-4H3,(H,24,25);2-7,12H,8-11,13-14H2,1H3,(H2,19,20).

What are the key properties of 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine?

8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine has a molecular weight of 1954.83 g/mol, XLogP of 20.33, 23 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3,5-dimethoxyphenyl)-2,3-dimethyl-N-[5-(piperazin-1-ylmethyl)-2-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-dichloro-3-methoxy-5-methylphenyl)-2,3-dimethylquinoxaline-5-carboxylic acid;5-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]methyl]pyridin-2-amine is sourced from PubChem (CID 159851314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).