2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine

C114H121Br2Cl2F9N28O — CID 159481489

About 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine

2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine (PubChem CID 159481489) has the molecular formula C114H121Br2Cl2F9N28O and a molecular weight of 2301.11 g/mol. Its IUPAC name is 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine.

Molecular Properties

• Compound Name: 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine
• PubChem CID: 159481489
• Molecular Formula: C114H121Br2Cl2F9N28O
• Molecular Weight: 2301.11 g/mol
• Exact Mass: 2296.79
• IUPAC Name: 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine
• SMILES: CC(C)(C)c1ccc(Nc2nccc3c2CCN(c2ncccc2Cl)C3)cc1.CC1c2cc(CCN3CCNCC3)nc(Nc3ccc(Br)nc3)c2CCN1c1cnccc1Cl.CCN(CC)c1ccc(Nc2nccc3c2CC(C)N(c2ncccc2OC)C3)cc1Br.Cc1nccnc1N1CCc2c(cc(N(C)C)nc2Nc2ccc(C(F)(F)F)nc2)C1.FC(F)(F)c1ccc(Nc2nccc3c2CCN(c2ncccc2C(F)(F)F)C3)nc1
• InChI: InChI=1S/C25H29BrClN7.C25H30BrN5O.C23H25ClN4.C21H22F3N7.C20H15F6N5/c1-17-21-14-18(5-10-33-12-8-28-9-13-33)31-25(32-19-2-3-24(26)30-15-19)20(21)6-11-34(17)23-16-29-7-4-22(23)27;1-5-30(6-2)22-10-9-19(15-21(22)26)29-24-20-14-17(3)31(16-18(20)11-13-27-24)25-23(32-4)8-7-12-28-25;1-23(2,3)17-6-8-18(9-7-17)27-21-19-11-14-28(15-16(19)10-13-25-21)22-20(24)5-4-12-26-22;1-13-20(26-8-7-25-13)31-9-6-16-14(12-31)10-18(30(2)3)29-19(16)28-15-4-5-17(27-11-15)21(22,23)24;21-19(22,23)13-3-4-16(29-10-13)30-17-14-6-9-31(11-12(14)5-8-27-17)18-15(20(24,25)26)2-1-7-28-18/h2-4,7,14-17,28H,5-6,8-13H2,1H3,(H,31,32);7-13,15,17H,5-6,14,16H2,1-4H3,(H,27,29);4-10,12-13H,11,14-15H2,1-3H3,(H,25,27);4-5,7-8,10-11H,6,9,12H2,1-3H3,(H,28,29);1-5,7-8,10H,6,9,11H2,(H,27,29,30)
• InChIKey: LXBDTLLMCYUUKJ-UHFFFAOYSA-N
• XLogP: 25.31
• TPSA: 287.79 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 29
• Rotatable Bonds: 23
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2301.11
LogP ≤ 5	25.31
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine?

The IUPAC name of 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine (CID 159481489) is 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine.

What is the SMILES notation for 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine?

The canonical SMILES for 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine is CC(C)(C)c1ccc(Nc2nccc3c2CCN(c2ncccc2Cl)C3)cc1.CC1c2cc(CCN3CCNCC3)nc(Nc3ccc(Br)nc3)c2CCN1c1cnccc1Cl.CCN(CC)c1ccc(Nc2nccc3c2CC(C)N(c2ncccc2OC)C3)cc1Br.Cc1nccnc1N1CCc2c(cc(N(C)C)nc2Nc2ccc(C(F)(F)F)nc2)C1.FC(F)(F)c1ccc(Nc2nccc3c2CCN(c2ncccc2C(F)(F)F)C3)nc1.

What is the InChIKey of 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine?

The InChIKey is LXBDTLLMCYUUKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29BrClN7.C25H30BrN5O.C23H25ClN4.C21H22F3N7.C20H15F6N5/c1-17-21-14-18(5-10-33-12-8-28-9-13-33)31-25(32-19-2-3-24(26)30-15-19)20(21)6-11-34(17)23-16-29-7-4-22(23)27;1-5-30(6-2)22-10-9-19(15-21(22)26)29-24-20-14-17(3)31(16-18(20)11-13-27-24)25-23(32-4)8-7-12-28-25;1-23(2,3)17-6-8-18(9-7-17)27-21-19-11-14-28(15-16(19)10-13-25-21)22-20(24)5-4-12-26-22;1-13-20(26-8-7-25-13)31-9-6-16-14(12-31)10-18(30(2)3)29-19(16)28-15-4-5-17(27-11-15)21(22,23)24;21-19(22,23)13-3-4-16(29-10-13)30-17-14-6-9-31(11-12(14)5-8-27-17)18-15(20(24,25)26)2-1-7-28-18/h2-4,7,14-17,28H,5-6,8-13H2,1H3,(H,31,32);7-13,15,17H,5-6,14,16H2,1-4H3,(H,27,29);4-10,12-13H,11,14-15H2,1-3H3,(H,25,27);4-5,7-8,10-11H,6,9,12H2,1-3H3,(H,28,29);1-5,7-8,10H,6,9,11H2,(H,27,29,30).

What are the key properties of 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine?

2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine has a molecular weight of 2301.11 g/mol, XLogP of 25.31, 23 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-1-N,1-N-diethyl-4-N-[6-(3-methoxy-2-pyridinyl)-7-methyl-7,8-dihydro-5H-2,6-naphthyridin-1-yl]benzene-1,4-diamine;N-(6-bromo-3-pyridinyl)-6-(4-chloro-3-pyridinyl)-5-methyl-3-(2-piperazin-1-ylethyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;N-(4-tert-butylphenyl)-6-(3-chloro-2-pyridinyl)-7,8-dihydro-5H-2,6-naphthyridin-1-amine;3-N,3-N-dimethyl-6-(3-methylpyrazin-2-yl)-1-N-[6-(trifluoromethyl)-3-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-1,3-diamine;6-[3-(trifluoromethyl)-2-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridin-1-amine is sourced from PubChem (CID 159481489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).