1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide

C118H164N30O25S5 — CID 157085294

About 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide

1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide (PubChem CID 157085294) has the molecular formula C118H164N30O25S5 and a molecular weight of 2563.13 g/mol. Its IUPAC name is 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide.

Molecular Properties

• Compound Name: 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide
• PubChem CID: 157085294
• Molecular Formula: C118H164N30O25S5
• Molecular Weight: 2563.13 g/mol
• Exact Mass: 2561.11
• IUPAC Name: 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide
• SMILES: CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)C(C)(C)C(=O)N(C)C)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)[C@H](C)C(=O)N(C)C)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)[C@H](C)C(=O)NC)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(CC)CC(=O)N(CC)CC)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCCC4C(=O)N(C)C)ccc3OCC)nn12
• InChI: InChI=1S/C25H36N6O5S.C24H32N6O5S.C24H34N6O5S.C23H32N6O5S.C22H30N6O5S/c1-7-12-21-26-17(6)23-25(33)27-24(28-31(21)23)19-15-18(13-14-20(19)36-11-5)37(34,35)30(10-4)16-22(32)29(8-2)9-3;1-6-9-20-25-15(3)21-23(31)26-22(27-30(20)21)17-14-16(11-12-19(17)35-7-2)36(33,34)29-13-8-10-18(29)24(32)28(4)5;1-9-11-19-25-15(3)20-22(31)26-21(27-30(19)20)17-14-16(12-13-18(17)35-10-2)36(33,34)29(8)24(4,5)23(32)28(6)7;1-8-10-19-24-14(3)20-22(30)25-21(26-29(19)20)17-13-16(11-12-18(17)34-9-2)35(32,33)28(7)15(4)23(31)27(5)6;1-7-9-18-24-13(3)19-22(30)25-20(26-28(18)19)16-12-15(10-11-17(16)33-8-2)34(31,32)27(6)14(4)21(29)23-5/h13-15H,7-12,16H2,1-6H3,(H,27,28,33);11-12,14,18H,6-10,13H2,1-5H3,(H,26,27,31);12-14H,9-11H2,1-8H3,(H,26,27,31);11-13,15H,8-10H2,1-7H3,(H,25,26,30);10-12,14H,7-9H2,1-6H3,(H,23,29)(H,25,26,30)/t;;;15-;14-/m...11/s1
• InChIKey: AEABKARIXOXQPA-BBDWUUKOSA-N
• XLogP: 10.18
• TPSA: 658.64 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 40
• Rotatable Bonds: 47
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2563.13
LogP ≤ 5	10.18
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide?

The IUPAC name of 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide (CID 157085294) is 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide.

What is the SMILES notation for 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide?

The canonical SMILES for 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide is CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)C(C)(C)C(=O)N(C)C)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)[C@H](C)C(=O)N(C)C)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(C)[C@H](C)C(=O)NC)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N(CC)CC(=O)N(CC)CC)ccc3OCC)nn12.CCCc1nc(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCCC4C(=O)N(C)C)ccc3OCC)nn12.

What is the InChIKey of 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide?

The InChIKey is AEABKARIXOXQPA-BBDWUUKOSA-N. The full InChI is InChI=1S/C25H36N6O5S.C24H32N6O5S.C24H34N6O5S.C23H32N6O5S.C22H30N6O5S/c1-7-12-21-26-17(6)23-25(33)27-24(28-31(21)23)19-15-18(13-14-20(19)36-11-5)37(34,35)30(10-4)16-22(32)29(8-2)9-3;1-6-9-20-25-15(3)21-23(31)26-22(27-30(20)21)17-14-16(11-12-19(17)35-7-2)36(33,34)29-13-8-10-18(29)24(32)28(4)5;1-9-11-19-25-15(3)20-22(31)26-21(27-30(19)20)17-14-16(12-13-18(17)35-10-2)36(33,34)29(8)24(4,5)23(32)28(6)7;1-8-10-19-24-14(3)20-22(30)25-21(26-29(19)20)17-13-16(11-12-18(17)34-9-2)35(32,33)28(7)15(4)23(31)27(5)6;1-7-9-18-24-13(3)19-22(30)25-20(26-28(18)19)16-12-15(10-11-17(16)33-8-2)34(31,32)27(6)14(4)21(29)23-5/h13-15H,7-12,16H2,1-6H3,(H,27,28,33);11-12,14,18H,6-10,13H2,1-5H3,(H,26,27,31);12-14H,9-11H2,1-8H3,(H,26,27,31);11-13,15H,8-10H2,1-7H3,(H,25,26,30);10-12,14H,7-9H2,1-6H3,(H,23,29)(H,25,26,30)/t;;;15-;14-/m...11/s1.

What are the key properties of 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide?

1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide has a molecular weight of 2563.13 g/mol, XLogP of 10.18, 47 rotatable bonds, 6 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-N,N-dimethylpyrrolidine-2-carboxamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-ethylamino]-N,N-diethylacetamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N-dimethylpropanamide;(2R)-2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N-methylpropanamide;2-[[4-ethoxy-3-(5-methyl-4-oxo-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-2-yl)phenyl]sulfonyl-methylamino]-N,N,2-trimethylpropanamide is sourced from PubChem (CID 157085294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).