bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide

C147H191N25O15 — CID 157487315

About bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide

bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide (PubChem CID 157487315) has the molecular formula C147H191N25O15 and a molecular weight of 2548.30 g/mol. Its IUPAC name is bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide
• PubChem CID: 157487315
• Molecular Formula: C147H191N25O15
• Molecular Weight: 2548.30 g/mol
• Exact Mass: 2546.50
• IUPAC Name: bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide
• SMILES: CC1(C)CC1C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.CC1(C)CC1C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.CC1(CC(=O)N2CCC3(CC2)CC3CNC(=O)N2Cc3ccncc3C2)CCCC1.Cc1cc(C)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3cnccc3[nH]2)o1.Cn1cc(-c2ccno2)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3cnccc3[nH]2)n1.[H]/N=C/C=C(\C=C)CN(C)CNCC1CC1CCN(CC)C(C)/C(C=C)=C/C=C/C(=O)C1CCC(C)CC1
• InChI: InChI=1S/C32H52N4O.C24H25N7O3.C24H34N4O2.C23H26N4O3.2C22H27N3O3/c1-7-27(17-19-33)23-35(6)24-34-22-31-21-30(31)18-20-36(9-3)26(5)28(8-2)11-10-12-32(37)29-15-13-25(4)14-16-29;1-30-14-17(20-3-7-27-34-20)21(29-30)23(33)31-8-4-24(5-9-31)11-16(24)13-26-22(32)19-10-15-12-25-6-2-18(15)28-19;1-23(5-2-3-6-23)13-21(29)27-10-7-24(8-11-27)12-20(24)15-26-22(30)28-16-18-4-9-25-14-19(18)17-28;1-14-9-15(2)30-20(14)22(29)27-7-4-23(5-8-27)11-17(23)13-25-21(28)19-10-16-12-24-6-3-18(16)26-19;2*1-21(2)11-16(21)20(27)25-7-4-22(5-8-25)10-15(22)12-24-19(26)17-9-14-3-6-23-13-18(14)28-17/h7-8,10-12,17,19,25-26,29-31,33-34H,1-2,9,13-16,18,20-24H2,3-6H3;2-3,6-7,10,12,14,16,28H,4-5,8-9,11,13H2,1H3,(H,26,32);4,9,14,20H,2-3,5-8,10-13,15-17H2,1H3,(H,26,30);3,6,9-10,12,17,26H,4-5,7-8,11,13H2,1-2H3,(H,25,28);2*3,6,9,13,15-16H,4-5,7-8,10-12H2,1-2H3,(H,24,26)/b12-10+,27-17+,28-11+,33-19+
• InChIKey: BWWGIGCXEQSKAA-WHHGNZGGSA-N
• XLogP: 22.27
• TPSA: 489.02 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 27
• Rotatable Bonds: 39
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2548.30
LogP ≤ 5	22.27
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide?

The IUPAC name of bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide (CID 157487315) is bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide.

What is the SMILES notation for bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide?

The canonical SMILES for bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide is CC1(C)CC1C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.CC1(C)CC1C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.CC1(CC(=O)N2CCC3(CC2)CC3CNC(=O)N2Cc3ccncc3C2)CCCC1.Cc1cc(C)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3cnccc3[nH]2)o1.Cn1cc(-c2ccno2)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3cnccc3[nH]2)n1.[H]/N=C/C=C(\C=C)CN(C)CNCC1CC1CCN(CC)C(C)/C(C=C)=C/C=C/C(=O)C1CCC(C)CC1.

What is the InChIKey of bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide?

The InChIKey is BWWGIGCXEQSKAA-WHHGNZGGSA-N. The full InChI is InChI=1S/C32H52N4O.C24H25N7O3.C24H34N4O2.C23H26N4O3.2C22H27N3O3/c1-7-27(17-19-33)23-35(6)24-34-22-31-21-30(31)18-20-36(9-3)26(5)28(8-2)11-10-12-32(37)29-15-13-25(4)14-16-29;1-30-14-17(20-3-7-27-34-20)21(29-30)23(33)31-8-4-24(5-9-31)11-16(24)13-26-22(32)19-10-15-12-25-6-2-18(15)28-19;1-23(5-2-3-6-23)13-21(29)27-10-7-24(8-11-27)12-20(24)15-26-22(30)28-16-18-4-9-25-14-19(18)17-28;1-14-9-15(2)30-20(14)22(29)27-7-4-23(5-8-27)11-17(23)13-25-21(28)19-10-16-12-24-6-3-18(16)26-19;2*1-21(2)11-16(21)20(27)25-7-4-22(5-8-25)10-15(22)12-24-19(26)17-9-14-3-6-23-13-18(14)28-17/h7-8,10-12,17,19,25-26,29-31,33-34H,1-2,9,13-16,18,20-24H2,3-6H3;2-3,6-7,10,12,14,16,28H,4-5,8-9,11,13H2,1H3,(H,26,32);4,9,14,20H,2-3,5-8,10-13,15-17H2,1H3,(H,26,30);3,6,9-10,12,17,26H,4-5,7-8,11,13H2,1-2H3,(H,25,28);2*3,6,9,13,15-16H,4-5,7-8,10-12H2,1-2H3,(H,24,26)/b12-10+,27-17+,28-11+,33-19+;;;;;.

What are the key properties of bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide?

bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide has a molecular weight of 2548.30 g/mol, XLogP of 22.27, 39 rotatable bonds, 9 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for bis(N-[[6-(2,2-dimethylcyclopropanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide);N-[[6-(3,5-dimethylfuran-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;(2E,4E)-5-[1-[2-[2-[[[[(E)-2-ethenyl-4-iminobut-2-enyl]-methylamino]methylamino]methyl]cyclopropyl]ethyl-ethylamino]ethyl]-1-(4-methylcyclohexyl)hepta-2,4,6-trien-1-one;N-[[6-[2-(1-methylcyclopentyl)acetyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide;N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 157487315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).