3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride

C121H159ClF12N28O14S — CID 159251825

About 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride

3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride (PubChem CID 159251825) has the molecular formula C121H159ClF12N28O14S and a molecular weight of 2525.28 g/mol. Its IUPAC name is 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride.

Molecular Properties

• Compound Name: 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride
• PubChem CID: 159251825
• Molecular Formula: C121H159ClF12N28O14S
• Molecular Weight: 2525.28 g/mol
• Exact Mass: 2523.18
• IUPAC Name: 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride
• SMILES: CCN(c1c(C)c(C(=O)NCc2c(OC)cc(C)[nH]c2=O)cc2c(-c3ccnc(N(C)C)c3)ncn12)C1CCN(CC(F)(F)F)CC1.CCN(c1c(C)c(C(=O)O)cc2c(-c3ccnc(N(C)C)c3)ncn12)C1CCN(CC(F)(F)F)CC1.CCOC(=O)c1cc2c(-c3ccnc(N(C)C)c3)ncn2c(N(CC)C2CCN(CC(F)(F)F)CC2)c1C.CCOC(=O)c1cc2c(-c3ccnc(N(C)C)c3)ncn2c(N(CC)C2CCNCC2)c1C.CCOS(=O)(=O)C(F)(F)F.COc1cc(C)[nH]c(=O)c1CN.Cl
• InChI: InChI=1S/C33H41F3N8O3.C27H35F3N6O2.C25H31F3N6O2.C25H34N6O2.C8H12N2O2.C3H5F3O3S.ClH/c1-7-43(23-9-12-42(13-10-23)18-33(34,35)36)32-21(3)24(30(45)38-17-25-27(47-6)14-20(2)40-31(25)46)16-26-29(39-19-44(26)32)22-8-11-37-28(15-22)41(4)5;1-6-35(20-9-12-34(13-10-20)16-27(28,29)30)25-18(3)21(26(37)38-7-2)15-22-24(32-17-36(22)25)19-8-11-31-23(14-19)33(4)5;1-5-33(18-7-10-32(11-8-18)14-25(26,27)28)23-16(2)19(24(35)36)13-20-22(30-15-34(20)23)17-6-9-29-21(12-17)31(3)4;1-6-30(19-9-11-26-12-10-19)24-17(3)20(25(32)33-7-2)15-21-23(28-16-31(21)24)18-8-13-27-22(14-18)29(4)5;1-5-3-7(12-2)6(4-9)8(11)10-5;1-2-9-10(7,8)3(4,5)6;/h8,11,14-16,19,23H,7,9-10,12-13,17-18H2,1-6H3,(H,38,45)(H,40,46);8,11,14-15,17,20H,6-7,9-10,12-13,16H2,1-5H3;6,9,12-13,15,18H,5,7-8,10-11,14H2,1-4H3,(H,35,36);8,13-16,19,26H,6-7,9-12H2,1-5H3;3H,4,9H2,1-2H3,(H,10,11);2H2,1H3;1H
• InChIKey: ILFZAVSYLSVHGY-UHFFFAOYSA-N
• XLogP: 18.65
• TPSA: 441.00 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 38
• Rotatable Bonds: 36
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2525.28
LogP ≤ 5	18.65
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}, {'alert_name': 'triflate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride?

The IUPAC name of 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride (CID 159251825) is 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride.

What is the SMILES notation for 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride?

The canonical SMILES for 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride is CCN(c1c(C)c(C(=O)NCc2c(OC)cc(C)[nH]c2=O)cc2c(-c3ccnc(N(C)C)c3)ncn12)C1CCN(CC(F)(F)F)CC1.CCN(c1c(C)c(C(=O)O)cc2c(-c3ccnc(N(C)C)c3)ncn12)C1CCN(CC(F)(F)F)CC1.CCOC(=O)c1cc2c(-c3ccnc(N(C)C)c3)ncn2c(N(CC)C2CCN(CC(F)(F)F)CC2)c1C.CCOC(=O)c1cc2c(-c3ccnc(N(C)C)c3)ncn2c(N(CC)C2CCNCC2)c1C.CCOS(=O)(=O)C(F)(F)F.COc1cc(C)[nH]c(=O)c1CN.Cl.

What is the InChIKey of 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride?

The InChIKey is ILFZAVSYLSVHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H41F3N8O3.C27H35F3N6O2.C25H31F3N6O2.C25H34N6O2.C8H12N2O2.C3H5F3O3S.ClH/c1-7-43(23-9-12-42(13-10-23)18-33(34,35)36)32-21(3)24(30(45)38-17-25-27(47-6)14-20(2)40-31(25)46)16-26-29(39-19-44(26)32)22-8-11-37-28(15-22)41(4)5;1-6-35(20-9-12-34(13-10-20)16-27(28,29)30)25-18(3)21(26(37)38-7-2)15-22-24(32-17-36(22)25)19-8-11-31-23(14-19)33(4)5;1-5-33(18-7-10-32(11-8-18)14-25(26,27)28)23-16(2)19(24(35)36)13-20-22(30-15-34(20)23)17-6-9-29-21(12-17)31(3)4;1-6-30(19-9-11-26-12-10-19)24-17(3)20(25(32)33-7-2)15-21-23(28-16-31(21)24)18-8-13-27-22(14-18)29(4)5;1-5-3-7(12-2)6(4-9)8(11)10-5;1-2-9-10(7,8)3(4,5)6;/h8,11,14-16,19,23H,7,9-10,12-13,17-18H2,1-6H3,(H,38,45)(H,40,46);8,11,14-15,17,20H,6-7,9-10,12-13,16H2,1-5H3;6,9,12-13,15,18H,5,7-8,10-11,14H2,1-4H3,(H,35,36);8,13-16,19,26H,6-7,9-12H2,1-5H3;3H,4,9H2,1-2H3,(H,10,11);2H2,1H3;1H.

What are the key properties of 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride?

3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride has a molecular weight of 2525.28 g/mol, XLogP of 18.65, 36 rotatable bonds, 6 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(aminomethyl)-4-methoxy-6-methyl-1H-pyridin-2-one;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-6-methylimidazo[1,5-a]pyridine-7-carboxamide;1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylic acid;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl(piperidin-4-yl)amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl 1-[2-(dimethylamino)-4-pyridinyl]-5-[ethyl-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]-6-methylimidazo[1,5-a]pyridine-7-carboxylate;ethyl trifluoromethanesulfonate;hydrochloride is sourced from PubChem (CID 159251825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).