lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide

C103H109B2Cl3LiN27O14 — CID 158073793

About lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide

lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide (PubChem CID 158073793) has the molecular formula C103H109B2Cl3LiN27O14 and a molecular weight of 2084.10 g/mol. Its IUPAC name is lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide.

Molecular Properties

• Compound Name: lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide
• PubChem CID: 158073793
• Molecular Formula: C103H109B2Cl3LiN27O14
• Molecular Weight: 2084.10 g/mol
• Exact Mass: 2081.81
• IUPAC Name: lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide
• SMILES: C.CN1CCC[C@@H]1CN.COC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(-c2ccccc2)nc1N.COC(=O)c1nc(Cl)c(-c2ccccc2)nc1N.COC(=O)c1nc(Cl)c(Cl)nc1N.Cc1cnc2ccc(-c3nc(C(=O)NC[C@H]4CCCN4C)c(N)nc3-c3ccccc3)cn12.Cc1cnc2ccc(-c3nc(C(=O)O)c(N)nc3-c3ccccc3)cn12.Cc1cnc2ccc(B(O)O)cn12.OB(O)c1ccccc1.[Li+].[OH-]
• InChI: InChI=1S/C25H27N7O.C20H17N5O2.C19H15N5O2.C12H10ClN3O2.C8H9BN2O2.C6H7BO2.C6H5Cl2N3O2.C6H14N2.CH4.Li.H2O/c1-16-13-27-20-11-10-18(15-32(16)20)22-21(17-7-4-3-5-8-17)30-24(26)23(29-22)25(33)28-14-19-9-6-12-31(19)2;1-12-10-22-15-9-8-14(11-25(12)15)17-16(13-6-4-3-5-7-13)24-19(21)18(23-17)20(26)27-2;1-11-9-21-14-8-7-13(10-24(11)14)16-15(12-5-3-2-4-6-12)23-18(20)17(22-16)19(25)26;1-18-12(17)9-11(14)16-8(10(13)15-9)7-5-3-2-4-6-7;1-6-4-10-8-3-2-7(9(12)13)5-11(6)8;8-7(9)6-4-2-1-3-5-6;1-13-6(12)2-5(9)11-4(8)3(7)10-2;1-8-4-2-3-6(8)5-7;;;/h3-5,7-8,10-11,13,15,19H,6,9,12,14H2,1-2H3,(H2,26,30)(H,28,33);3-11H,1-2H3,(H2,21,24);2-10H,1H3,(H2,20,23)(H,25,26);2-6H,1H3,(H2,14,16);2-5,12-13H,1H3;1-5,8-9H;1H3,(H2,9,11);6H,2-5,7H2,1H3;1H4;;1H2/q;;;;;;;;;+1;/p-1/t19-;;;;;;;6-;;;/m1......1.../s1
• InChIKey: FMCZSNDUPGCZSQ-HWCYBCILSA-M
• XLogP: 8.87
• TPSA: 616.92 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 39
• Rotatable Bonds: 17
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2084.10
LogP ≤ 5	8.87
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide?

The IUPAC name of lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide (CID 158073793) is lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide.

What is the SMILES notation for lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide?

The canonical SMILES for lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide is C.CN1CCC[C@@H]1CN.COC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(-c2ccccc2)nc1N.COC(=O)c1nc(Cl)c(-c2ccccc2)nc1N.COC(=O)c1nc(Cl)c(Cl)nc1N.Cc1cnc2ccc(-c3nc(C(=O)NC[C@H]4CCCN4C)c(N)nc3-c3ccccc3)cn12.Cc1cnc2ccc(-c3nc(C(=O)O)c(N)nc3-c3ccccc3)cn12.Cc1cnc2ccc(B(O)O)cn12.OB(O)c1ccccc1.[Li+].[OH-].

What is the InChIKey of lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide?

The InChIKey is FMCZSNDUPGCZSQ-HWCYBCILSA-M. The full InChI is InChI=1S/C25H27N7O.C20H17N5O2.C19H15N5O2.C12H10ClN3O2.C8H9BN2O2.C6H7BO2.C6H5Cl2N3O2.C6H14N2.CH4.Li.H2O/c1-16-13-27-20-11-10-18(15-32(16)20)22-21(17-7-4-3-5-8-17)30-24(26)23(29-22)25(33)28-14-19-9-6-12-31(19)2;1-12-10-22-15-9-8-14(11-25(12)15)17-16(13-6-4-3-5-7-13)24-19(21)18(23-17)20(26)27-2;1-11-9-21-14-8-7-13(10-24(11)14)16-15(12-5-3-2-4-6-12)23-18(20)17(22-16)19(25)26;1-18-12(17)9-11(14)16-8(10(13)15-9)7-5-3-2-4-6-7;1-6-4-10-8-3-2-7(9(12)13)5-11(6)8;8-7(9)6-4-2-1-3-5-6;1-13-6(12)2-5(9)11-4(8)3(7)10-2;1-8-4-2-3-6(8)5-7;;;/h3-5,7-8,10-11,13,15,19H,6,9,12,14H2,1-2H3,(H2,26,30)(H,28,33);3-11H,1-2H3,(H2,21,24);2-10H,1H3,(H2,20,23)(H,25,26);2-6H,1H3,(H2,14,16);2-5,12-13H,1H3;1-5,8-9H;1H3,(H2,9,11);6H,2-5,7H2,1H3;1H4;;1H2/q;;;;;;;;;+1;/p-1/t19-;;;;;;;6-;;;/m1......1.../s1.

What are the key properties of lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide?

lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide has a molecular weight of 2084.10 g/mol, XLogP of 8.87, 17 rotatable bonds, 12 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-phenylpyrazine-2-carboxamide;3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylic acid;methane;methyl 3-amino-6-chloro-5-phenylpyrazine-2-carboxylate;methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;methyl 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-phenylpyrazine-2-carboxylate;(3-methylimidazo[1,2-a]pyridin-6-yl)boronic acid;[(2R)-1-methylpyrrolidin-2-yl]methanamine;phenylboronic acid;hydroxide is sourced from PubChem (CID 158073793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).