N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide

C101H108N26O11S5 — CID 158160643

About N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide

N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide (PubChem CID 158160643) has the molecular formula C101H108N26O11S5 and a molecular weight of 2022.48 g/mol. Its IUPAC name is N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

• Compound Name: N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide
• PubChem CID: 158160643
• Molecular Formula: C101H108N26O11S5
• Molecular Weight: 2022.48 g/mol
• Exact Mass: 2020.73
• IUPAC Name: N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide
• SMILES: COCCOc1ccc2c(c1)C(=O)N(c1nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs1)C2.COc1ccc2c(c1)n(C)c(=O)n2-c1nc(C(=O)Nc2cnccc2N2CCC3(CC2)CNC3)cs1.CSc1ccc2c(c1)C(=O)N(c1nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs1)C2.Cn1c(=O)n(-c2nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs2)c2ccccc21
• InChI: InChI=1S/C27H30N6O4S.C25H27N7O3S.C25H26N6O2S2.C24H25N7O2S/c1-36-10-11-37-19-3-2-18-14-33(25(35)20(18)12-19)26-31-22(15-38-26)24(34)30-21-13-28-7-4-23(21)32-8-5-27(6-9-32)16-29-17-27;1-30-21-11-16(35-2)3-4-20(21)32(24(30)34)23-29-18(13-36-23)22(33)28-17-12-26-8-5-19(17)31-9-6-25(7-10-31)14-27-15-25;1-34-17-3-2-16-12-31(23(33)18(16)10-17)24-29-20(13-35-24)22(32)28-19-11-26-7-4-21(19)30-8-5-25(6-9-30)14-27-15-25;1-29-19-4-2-3-5-20(19)31(23(29)33)22-28-17(13-34-22)21(32)27-16-12-25-9-6-18(16)30-10-7-24(8-11-30)14-26-15-24/h2-4,7,12-13,15,29H,5-6,8-11,14,16-17H2,1H3,(H,30,34);3-5,8,11-13,27H,6-7,9-10,14-15H2,1-2H3,(H,28,33);2-4,7,10-11,13,27H,5-6,8-9,12,14-15H2,1H3,(H,28,32);2-6,9,12-13,26H,7-8,10-11,14-15H2,1H3,(H,27,32)
• InChIKey: FWFOXQZDDXKWOO-UHFFFAOYSA-N
• XLogP: 12.28
• TPSA: 402.77 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 36
• Rotatable Bonds: 22
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2022.48
LogP ≤ 5	12.28
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide?

The IUPAC name of N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide (CID 158160643) is N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide.

What is the SMILES notation for N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide?

The canonical SMILES for N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide is COCCOc1ccc2c(c1)C(=O)N(c1nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs1)C2.COc1ccc2c(c1)n(C)c(=O)n2-c1nc(C(=O)Nc2cnccc2N2CCC3(CC2)CNC3)cs1.CSc1ccc2c(c1)C(=O)N(c1nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs1)C2.Cn1c(=O)n(-c2nc(C(=O)Nc3cnccc3N3CCC4(CC3)CNC4)cs2)c2ccccc21.

What is the InChIKey of N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide?

The InChIKey is FWFOXQZDDXKWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N6O4S.C25H27N7O3S.C25H26N6O2S2.C24H25N7O2S/c1-36-10-11-37-19-3-2-18-14-33(25(35)20(18)12-19)26-31-22(15-38-26)24(34)30-21-13-28-7-4-23(21)32-8-5-27(6-9-32)16-29-17-27;1-30-21-11-16(35-2)3-4-20(21)32(24(30)34)23-29-18(13-36-23)22(33)28-17-12-26-8-5-19(17)31-9-6-25(7-10-31)14-27-15-25;1-34-17-3-2-16-12-31(23(33)18(16)10-17)24-29-20(13-35-24)22(32)28-19-11-26-7-4-21(19)30-8-5-25(6-9-30)14-27-15-25;1-29-19-4-2-3-5-20(19)31(23(29)33)22-28-17(13-34-22)21(32)27-16-12-25-9-6-18(16)30-10-7-24(8-11-30)14-26-15-24/h2-4,7,12-13,15,29H,5-6,8-11,14,16-17H2,1H3,(H,30,34);3-5,8,11-13,27H,6-7,9-10,14-15H2,1-2H3,(H,28,33);2-4,7,10-11,13,27H,5-6,8-9,12,14-15H2,1H3,(H,28,32);2-6,9,12-13,26H,7-8,10-11,14-15H2,1H3,(H,27,32).

What are the key properties of N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide?

N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 2022.48 g/mol, XLogP of 12.28, 22 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-[5-(2-methoxyethoxy)-3-oxo-1H-isoindol-2-yl]-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methoxy-3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)-1,3-thiazole-4-carboxamide;N-[4-(2,7-diazaspiro[3.5]nonan-7-yl)-3-pyridinyl]-2-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 158160643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).