[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid

C140H143ClN30O12 — CID 160751892

About [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid

[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid (PubChem CID 160751892) has the molecular formula C140H143ClN30O12 and a molecular weight of 2473.33 g/mol. Its IUPAC name is [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid.

Molecular Properties

• Compound Name: [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid
• PubChem CID: 160751892
• Molecular Formula: C140H143ClN30O12
• Molecular Weight: 2473.33 g/mol
• Exact Mass: 2471.12
• IUPAC Name: [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid
• SMILES: CC(C)(C)OC(=O)N[C@@H]1CCCNC1.CCOC(=O)c1ccn2c(C)c(-c3cc4ccccc4n3Cc3cnccn3)nc2c1.CCOC(=O)c1ccn2c(C)c(C3=Cc4ccccc4C3)nc2c1.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)N3CCC[C@@H](N)C3)ccn12.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)N3CCC[C@@H](NC(=O)OC(C)(C)C)C3)ccn12.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)O)ccn12.ClCc1cnccn1
• InChI: InChI=1S/C32H35N7O3.C27H27N7O.C24H21N5O2.C22H17N5O2.C20H18N2O2.C10H20N2O2.C5H5ClN2/c1-21-29(27-16-22-8-5-6-10-26(22)39(27)20-25-18-33-12-13-34-25)36-28-17-23(11-15-38(21)28)30(40)37-14-7-9-24(19-37)35-31(41)42-32(2,3)4;1-18-26(24-13-19-5-2-3-7-23(19)34(24)17-22-15-29-9-10-30-22)31-25-14-20(8-12-33(18)25)27(35)32-11-4-6-21(28)16-32;1-3-31-24(30)18-8-11-28-16(2)23(27-22(28)13-18)21-12-17-6-4-5-7-20(17)29(21)15-19-14-25-9-10-26-19;1-14-21(25-20-11-16(22(28)29)6-9-26(14)20)19-10-15-4-2-3-5-18(15)27(19)13-17-12-23-7-8-24-17;1-3-24-20(23)16-8-9-22-13(2)19(21-18(22)12-16)17-10-14-6-4-5-7-15(14)11-17;1-10(2,3)14-9(13)12-8-5-4-6-11-7-8;6-3-5-4-7-1-2-8-5/h5-6,8,10-13,15-18,24H,7,9,14,19-20H2,1-4H3,(H,35,41);2-3,5,7-10,12-15,21H,4,6,11,16-17,28H2,1H3;4-14H,3,15H2,1-2H3;2-12H,13H2,1H3,(H,28,29);4-10,12H,3,11H2,1-2H3;8,11H,4-7H2,1-3H3,(H,12,13);1-2,4H,3H2/t24-;21-;;;;8-;/m11...1./s1
• InChIKey: RWXYFBNIXFIJQI-ZEBZAMNGSA-N
• XLogP: 23.37
• TPSA: 480.35 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 37
• Rotatable Bonds: 23
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2473.33
LogP ≤ 5	23.37
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid?

The IUPAC name of [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid (CID 160751892) is [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid.

What is the SMILES notation for [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid?

The canonical SMILES for [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid is CC(C)(C)OC(=O)N[C@@H]1CCCNC1.CCOC(=O)c1ccn2c(C)c(-c3cc4ccccc4n3Cc3cnccn3)nc2c1.CCOC(=O)c1ccn2c(C)c(C3=Cc4ccccc4C3)nc2c1.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)N3CCC[C@@H](N)C3)ccn12.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)N3CCC[C@@H](NC(=O)OC(C)(C)C)C3)ccn12.Cc1c(-c2cc3ccccc3n2Cc2cnccn2)nc2cc(C(=O)O)ccn12.ClCc1cnccn1.

What is the InChIKey of [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid?

The InChIKey is RWXYFBNIXFIJQI-ZEBZAMNGSA-N. The full InChI is InChI=1S/C32H35N7O3.C27H27N7O.C24H21N5O2.C22H17N5O2.C20H18N2O2.C10H20N2O2.C5H5ClN2/c1-21-29(27-16-22-8-5-6-10-26(22)39(27)20-25-18-33-12-13-34-25)36-28-17-23(11-15-38(21)28)30(40)37-14-7-9-24(19-37)35-31(41)42-32(2,3)4;1-18-26(24-13-19-5-2-3-7-23(19)34(24)17-22-15-29-9-10-30-22)31-25-14-20(8-12-33(18)25)27(35)32-11-4-6-21(28)16-32;1-3-31-24(30)18-8-11-28-16(2)23(27-22(28)13-18)21-12-17-6-4-5-7-20(17)29(21)15-19-14-25-9-10-26-19;1-14-21(25-20-11-16(22(28)29)6-9-26(14)20)19-10-15-4-2-3-5-18(15)27(19)13-17-12-23-7-8-24-17;1-3-24-20(23)16-8-9-22-13(2)19(21-18(22)12-16)17-10-14-6-4-5-7-15(14)11-17;1-10(2,3)14-9(13)12-8-5-4-6-11-7-8;6-3-5-4-7-1-2-8-5/h5-6,8,10-13,15-18,24H,7,9,14,19-20H2,1-4H3,(H,35,41);2-3,5,7-10,12-15,21H,4,6,11,16-17,28H2,1H3;4-14H,3,15H2,1-2H3;2-12H,13H2,1H3,(H,28,29);4-10,12H,3,11H2,1-2H3;8,11H,4-7H2,1-3H3,(H,12,13);1-2,4H,3H2/t24-;21-;;;;8-;/m11...1./s1.

What are the key properties of [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid?

[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid has a molecular weight of 2473.33 g/mol, XLogP of 23.37, 23 rotatable bonds, 5 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for [(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridin-7-yl]methanone;tert-butyl N-[(3R)-1-[3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carbonyl]piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;2-(chloromethyl)pyrazine;ethyl 2-(1H-inden-2-yl)-3-methylimidazo[1,2-a]pyridine-7-carboxylate;ethyl 3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylate;3-methyl-2-[1-(pyrazin-2-ylmethyl)indol-2-yl]imidazo[1,2-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 160751892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).