N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide

C95H97FN22O9S4 — CID 158226917

About N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide

N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide (PubChem CID 158226917) has the molecular formula C95H97FN22O9S4 and a molecular weight of 1838.23 g/mol. Its IUPAC name is N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide.

Molecular Properties

• Compound Name: N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide
• PubChem CID: 158226917
• Molecular Formula: C95H97FN22O9S4
• Molecular Weight: 1838.23 g/mol
• Exact Mass: 1836.67
• IUPAC Name: N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide
• SMILES: CCn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4ccccc4)cc3)cc(C3CC3)nc21.CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(-c3cc(C4CC4)nc4c3c(N)nn4C)cc2)cc1.CN(C)Cc1ccc(S(=O)(=O)Nc2ccc(-c3cc(C4CC4)nc4c3c(N)nn4C)cc2)cc1.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(F)c4)cc3)cc(C3CC3)nc21
• InChI: InChI=1S/C25H26N6O3S.C25H28N6O2S.C23H23N5O2S.C22H20FN5O2S/c1-30(2)25(32)17-8-12-19(13-9-17)35(33,34)29-18-10-6-15(7-11-18)20-14-21(16-4-5-16)27-24-22(20)23(26)28-31(24)3;1-30(2)15-16-4-12-20(13-5-16)34(32,33)29-19-10-8-17(9-11-19)21-14-22(18-6-7-18)27-25-23(21)24(26)28-31(25)3;1-2-28-23-21(22(24)26-28)19(14-20(25-23)16-8-9-16)15-10-12-17(13-11-15)27-31(29,30)18-6-4-3-5-7-18;1-28-22-20(21(24)26-28)18(12-19(25-22)14-5-6-14)13-7-9-16(10-8-13)27-31(29,30)17-4-2-3-15(23)11-17/h6-14,16,29H,4-5H2,1-3H3,(H2,26,28);4-5,8-14,18,29H,6-7,15H2,1-3H3,(H2,26,28);3-7,10-14,16,27H,2,8-9H2,1H3,(H2,24,26);2-4,7-12,14,27H,5-6H2,1H3,(H2,24,26)
• InChIKey: GDXFLINNZBPVFJ-UHFFFAOYSA-N
• XLogP: 15.97
• TPSA: 435.15 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1838.23
LogP ≤ 5	15.97
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide?

The IUPAC name of N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide (CID 158226917) is N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide.

What is the SMILES notation for N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide?

The canonical SMILES for N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide is CCn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4ccccc4)cc3)cc(C3CC3)nc21.CN(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(-c3cc(C4CC4)nc4c3c(N)nn4C)cc2)cc1.CN(C)Cc1ccc(S(=O)(=O)Nc2ccc(-c3cc(C4CC4)nc4c3c(N)nn4C)cc2)cc1.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(F)c4)cc3)cc(C3CC3)nc21.

What is the InChIKey of N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide?

The InChIKey is GDXFLINNZBPVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O3S.C25H28N6O2S.C23H23N5O2S.C22H20FN5O2S/c1-30(2)25(32)17-8-12-19(13-9-17)35(33,34)29-18-10-6-15(7-11-18)20-14-21(16-4-5-16)27-24-22(20)23(26)28-31(24)3;1-30(2)15-16-4-12-20(13-5-16)34(32,33)29-19-10-8-17(9-11-19)21-14-22(18-6-7-18)27-25-23(21)24(26)28-31(25)3;1-2-28-23-21(22(24)26-28)19(14-20(25-23)16-8-9-16)15-10-12-17(13-11-15)27-31(29,30)18-6-4-3-5-7-18;1-28-22-20(21(24)26-28)18(12-19(25-22)14-5-6-14)13-7-9-16(10-8-13)27-31(29,30)17-4-2-3-15(23)11-17/h6-14,16,29H,4-5H2,1-3H3,(H2,26,28);4-5,8-14,18,29H,6-7,15H2,1-3H3,(H2,26,28);3-7,10-14,16,27H,2,8-9H2,1H3,(H2,24,26);2-4,7-12,14,27H,5-6H2,1H3,(H2,24,26).

What are the key properties of N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide?

N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide has a molecular weight of 1838.23 g/mol, XLogP of 15.97, 24 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(3-amino-6-cyclopropyl-1-ethylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-4-[(dimethylamino)methyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-fluorobenzenesulfonamide;4-[[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]sulfamoyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 158226917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).