3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide

C108H148FN31O13S6 — CID 158489406

About 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide

3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide (PubChem CID 158489406) has the molecular formula C108H148FN31O13S6 and a molecular weight of 2299.98 g/mol. Its IUPAC name is 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide.

Molecular Properties

• Compound Name: 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
• PubChem CID: 158489406
• Molecular Formula: C108H148FN31O13S6
• Molecular Weight: 2299.98 g/mol
• Exact Mass: 2298.02
• IUPAC Name: 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
• SMILES: CCN(CC)S(=O)(=O)c1ccc2nnc(NC3CCCCC3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccc(C)c(C)c3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccc(N(C)C)cc3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3cccc(C)c3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccccc3F)n2c1.O=S(=O)(c1ccc2nc(NCC(O)C3CCCCC3)nn2c1)N1CCCCC1
• InChI: InChI=1S/C19H26N6O2S.C19H29N5O3S.C19H25N5O2S.C18H23N5O2S.C17H20FN5O2S.C16H25N5O2S/c1-5-24(6-2)28(26,27)17-11-12-18-21-22-19(25(18)14-17)20-13-15-7-9-16(10-8-15)23(3)4;25-17(15-7-3-1-4-8-15)13-20-19-21-18-10-9-16(14-24(18)22-19)28(26,27)23-11-5-2-6-12-23;1-5-23(6-2)27(25,26)17-9-10-18-21-22-19(24(18)13-17)20-12-16-8-7-14(3)15(4)11-16;1-4-22(5-2)26(24,25)16-9-10-17-20-21-18(23(17)13-16)19-12-15-8-6-7-14(3)11-15;1-3-22(4-2)26(24,25)14-9-10-16-20-21-17(23(16)12-14)19-11-13-7-5-6-8-15(13)18;1-3-20(4-2)24(22,23)14-10-11-15-18-19-16(21(15)12-14)17-13-8-6-5-7-9-13/h7-12,14H,5-6,13H2,1-4H3,(H,20,22);9-10,14-15,17,25H,1-8,11-13H2,(H,20,22);7-11,13H,5-6,12H2,1-4H3,(H,20,22);6-11,13H,4-5,12H2,1-3H3,(H,19,21);5-10,12H,3-4,11H2,1-2H3,(H,19,21);10-13H,3-9H2,1-2H3,(H,17,19)
• InChIKey: HIMXBMZELZNWNB-UHFFFAOYSA-N
• XLogP: 15.38
• TPSA: 501.07 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 38
• Rotatable Bonds: 41
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2299.98
LogP ≤ 5	15.38
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide?

The IUPAC name of 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide (CID 158489406) is 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide.

What is the SMILES notation for 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide?

The canonical SMILES for 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide is CCN(CC)S(=O)(=O)c1ccc2nnc(NC3CCCCC3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccc(C)c(C)c3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccc(N(C)C)cc3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3cccc(C)c3)n2c1.CCN(CC)S(=O)(=O)c1ccc2nnc(NCc3ccccc3F)n2c1.O=S(=O)(c1ccc2nc(NCC(O)C3CCCCC3)nn2c1)N1CCCCC1.

What is the InChIKey of 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide?

The InChIKey is HIMXBMZELZNWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O2S.C19H29N5O3S.C19H25N5O2S.C18H23N5O2S.C17H20FN5O2S.C16H25N5O2S/c1-5-24(6-2)28(26,27)17-11-12-18-21-22-19(25(18)14-17)20-13-15-7-9-16(10-8-15)23(3)4;25-17(15-7-3-1-4-8-15)13-20-19-21-18-10-9-16(14-24(18)22-19)28(26,27)23-11-5-2-6-12-23;1-5-23(6-2)27(25,26)17-9-10-18-21-22-19(24(18)13-17)20-12-16-8-7-14(3)15(4)11-16;1-4-22(5-2)26(24,25)16-9-10-17-20-21-18(23(17)13-16)19-12-15-8-6-7-14(3)11-15;1-3-22(4-2)26(24,25)14-9-10-16-20-21-17(23(16)12-14)19-11-13-7-5-6-8-15(13)18;1-3-20(4-2)24(22,23)14-10-11-15-18-19-16(21(15)12-14)17-13-8-6-5-7-9-13/h7-12,14H,5-6,13H2,1-4H3,(H,20,22);9-10,14-15,17,25H,1-8,11-13H2,(H,20,22);7-11,13H,5-6,12H2,1-4H3,(H,20,22);6-11,13H,4-5,12H2,1-3H3,(H,19,21);5-10,12H,3-4,11H2,1-2H3,(H,19,21);10-13H,3-9H2,1-2H3,(H,17,19).

What are the key properties of 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide?

3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide has a molecular weight of 2299.98 g/mol, XLogP of 15.38, 41 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(cyclohexylamino)-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;1-cyclohexyl-2-[(6-piperidin-1-ylsulfonyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethanol;N,N-diethyl-3-[(2-fluorophenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;N,N-diethyl-3-[(3-methylphenyl)methylamino]-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[[4-(dimethylamino)phenyl]methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide;3-[(3,4-dimethylphenyl)methylamino]-N,N-diethyl-[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide is sourced from PubChem (CID 158489406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).