5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine

C92H120Cl3N25O8 — CID 158389306

About 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine

5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine (PubChem CID 158389306) has the molecular formula C92H120Cl3N25O8 and a molecular weight of 1810.50 g/mol. Its IUPAC name is 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine.

Molecular Properties

• Compound Name: 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine
• PubChem CID: 158389306
• Molecular Formula: C92H120Cl3N25O8
• Molecular Weight: 1810.50 g/mol
• Exact Mass: 1807.88
• IUPAC Name: 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine
• SMILES: CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CC(N)C2.CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CC(Nc1nc(Cl)cc3ncccc13)C2.Cc1cc(N)nn1C(=O)OC(C)(C)C.Cc1cc(Nc2cc3ncccc3c(NC3C[C@H]4CC[C@@H](C3)N4)n2)n[nH]1.Cc1cc(Nc2cc3ncccc3c(NC3C[C@H]4CC[C@@H](C3)N4C(=O)OC(C)(C)C)n2)n[nH]1.Clc1cc2ncccc2c(Cl)n1
• InChI: InChI=1S/C24H31N7O2.C20H25ClN4O2.C19H23N7.C12H22N2O2.C9H15N3O2.C8H4Cl2N2/c1-14-10-21(30-29-14)27-20-13-19-18(6-5-9-25-19)22(28-20)26-15-11-16-7-8-17(12-15)31(16)23(32)33-24(2,3)4;1-20(2,3)27-19(26)25-13-6-7-14(25)10-12(9-13)23-18-15-5-4-8-22-16(15)11-17(21)24-18;1-11-7-18(26-25-11)23-17-10-16-15(3-2-6-20-16)19(24-17)22-14-8-12-4-5-13(9-14)21-12;1-12(2,3)16-11(15)14-9-4-5-10(14)7-8(13)6-9;1-6-5-7(10)11-12(6)8(13)14-9(2,3)4;9-7-4-6-5(8(10)12-7)2-1-3-11-6/h5-6,9-10,13,15-17H,7-8,11-12H2,1-4H3,(H3,26,27,28,29,30);4-5,8,11-14H,6-7,9-10H2,1-3H3,(H,23,24);2-3,6-7,10,12-14,21H,4-5,8-9H2,1H3,(H3,22,23,24,25,26);8-10H,4-7,13H2,1-3H3;5H,1-4H3,(H2,10,11);1-4H/t15?,16-,17+;12?,13-,14+;12-,13+,14?;8?,9-,10+
• InChIKey: GWTFHYLKPBHMJQ-CNOQIMRVSA-N
• XLogP: 18.84
• TPSA: 417.44 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 28
• Rotatable Bonds: 10
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1810.50
LogP ≤ 5	18.84
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine?

The IUPAC name of 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine (CID 158389306) is 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine.

What is the SMILES notation for 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine?

The canonical SMILES for 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine is CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CC(N)C2.CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CC(Nc1nc(Cl)cc3ncccc13)C2.Cc1cc(N)nn1C(=O)OC(C)(C)C.Cc1cc(Nc2cc3ncccc3c(NC3C[C@H]4CC[C@@H](C3)N4)n2)n[nH]1.Cc1cc(Nc2cc3ncccc3c(NC3C[C@H]4CC[C@@H](C3)N4C(=O)OC(C)(C)C)n2)n[nH]1.Clc1cc2ncccc2c(Cl)n1.

What is the InChIKey of 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine?

The InChIKey is GWTFHYLKPBHMJQ-CNOQIMRVSA-N. The full InChI is InChI=1S/C24H31N7O2.C20H25ClN4O2.C19H23N7.C12H22N2O2.C9H15N3O2.C8H4Cl2N2/c1-14-10-21(30-29-14)27-20-13-19-18(6-5-9-25-19)22(28-20)26-15-11-16-7-8-17(12-15)31(16)23(32)33-24(2,3)4;1-20(2,3)27-19(26)25-13-6-7-14(25)10-12(9-13)23-18-15-5-4-8-22-16(15)11-17(21)24-18;1-11-7-18(26-25-11)23-17-10-16-15(3-2-6-20-16)19(24-17)22-14-8-12-4-5-13(9-14)21-12;1-12(2,3)16-11(15)14-9-4-5-10(14)7-8(13)6-9;1-6-5-7(10)11-12(6)8(13)14-9(2,3)4;9-7-4-6-5(8(10)12-7)2-1-3-11-6/h5-6,9-10,13,15-17H,7-8,11-12H2,1-4H3,(H3,26,27,28,29,30);4-5,8,11-14H,6-7,9-10H2,1-3H3,(H,23,24);2-3,6-7,10,12-14,21H,4-5,8-9H2,1H3,(H3,22,23,24,25,26);8-10H,4-7,13H2,1-3H3;5H,1-4H3,(H2,10,11);1-4H/t15?,16-,17+;12?,13-,14+;12-,13+,14?;8?,9-,10+;;.

What are the key properties of 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine?

5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine has a molecular weight of 1810.50 g/mol, XLogP of 18.84, 10 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 5-N-[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]-7-N-(5-methyl-1H-pyrazol-3-yl)-1,6-naphthyridine-5,7-diamine;tert-butyl (1S,5R)-3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 3-amino-5-methylpyrazole-1-carboxylate;tert-butyl (1S,5R)-3-[(7-chloro-1,6-naphthyridin-5-yl)amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl (1S,5R)-3-[[7-[(5-methyl-1H-pyrazol-3-yl)amino]-1,6-naphthyridin-5-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate;5,7-dichloro-1,6-naphthyridine is sourced from PubChem (CID 158389306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).