magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride

C85H113BrCl5MgN21O4Sn — CID 160756054

IUPACmagnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride
SMILESBrc1cnc2ccccn12.CC(C)(C)OC(=O)N1CCC[C@H](N)C1.CC(C)(C)OC(=O)N1CCC[C@H](Nc2cncc(-c3cnc4ccccn34)n2)C1.CCCC[Sn](Cl)(CCCC)CCCC.C[CH-]C.Clc1cncc(-c2cnc3ccccn23)n1.Clc1cncc(Cl)n1.[Cl-].[Mg+2].c1ccn2c(-c3cncc(NC4CCCCC4)n3)cnc2c1
InChIInChI=1S/C21H26N6O2.C17H19N5.C11H7ClN4.C10H20N2O2.C7H5BrN2.C4H2Cl2N2.3C4H9.C3H7.2ClH.Mg.Sn/c1-21(2,3)29-20(28)26-9-6-7-15(14-26)24-18-13-22-11-16(25-18)17-12-23-19-8-4-5-10-27(17)19;1-2-6-13(7-3-1)20-16-12-18-10-14(21-16)15-11-19-17-8-4-5-9-22(15)17;12-10-7-13-5-8(15-10)9-6-14-11-3-1-2-4-16(9)11;1-10(2,3)14-9(13)12-6-4-5-8(11)7-12;8-6-5-9-7-3-1-2-4-10(6)7;5-3-1-7-2-4(6)8-3;3*1-3-4-2;1-3-2;;;;/h4-5,8,10-13,15H,6-7,9,14H2,1-3H3,(H,24,25);4-5,8-13H,1-3,6-7H2,(H,20,21);1-7H;8H,4-7,11H2,1-3H3;1-5H;1-2H;3*1,3-4H2,2H3;3H,1-2H3;2*1H;;/q;;;;;;;;;-1;;;+2;+1/p-2/t15-;;;8-;;;;;;;;;;/m0..0........../s1
InChIKeyGBJXYNISHRZHOT-JGPDYZAISA-L
MW1893.17 g/mol
LogP18.23
Rot. Bonds16

About magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride

magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride (PubChem CID 160756054) has the molecular formula C85H113BrCl5MgN21O4Sn and a molecular weight of 1893.17 g/mol. Its IUPAC name is magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride.

Molecular Properties

Compound Namemagnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride
PubChem CID160756054
Molecular FormulaC85H113BrCl5MgN21O4Sn
Molecular Weight1893.17 g/mol
Exact Mass1889.58
IUPAC Namemagnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride
SMILESBrc1cnc2ccccn12.CC(C)(C)OC(=O)N1CCC[C@H](N)C1.CC(C)(C)OC(=O)N1CCC[C@H](Nc2cncc(-c3cnc4ccccn34)n2)C1.CCCC[Sn](Cl)(CCCC)CCCC.C[CH-]C.Clc1cncc(-c2cnc3ccccn23)n1.Clc1cncc(Cl)n1.[Cl-].[Mg+2].c1ccn2c(-c3cncc(NC4CCCCC4)n3)cnc2c1
InChIInChI=1S/C21H26N6O2.C17H19N5.C11H7ClN4.C10H20N2O2.C7H5BrN2.C4H2Cl2N2.3C4H9.C3H7.2ClH.Mg.Sn/c1-21(2,3)29-20(28)26-9-6-7-15(14-26)24-18-13-22-11-16(25-18)17-12-23-19-8-4-5-10-27(17)19;1-2-6-13(7-3-1)20-16-12-18-10-14(21-16)15-11-19-17-8-4-5-9-22(15)17;12-10-7-13-5-8(15-10)9-6-14-11-3-1-2-4-16(9)11;1-10(2,3)14-9(13)12-6-4-5-8(11)7-12;8-6-5-9-7-3-1-2-4-10(6)7;5-3-1-7-2-4(6)8-3;3*1-3-4-2;1-3-2;;;;/h4-5,8,10-13,15H,6-7,9,14H2,1-3H3,(H,24,25);4-5,8-13H,1-3,6-7H2,(H,20,21);1-7H;8H,4-7,11H2,1-3H3;1-5H;1-2H;3*1,3-4H2,2H3;3H,1-2H3;2*1H;;/q;;;;;;;;;-1;;;+2;+1/p-2/t15-;;;8-;;;;;;;;;;/m0..0........../s1
InChIKeyGBJXYNISHRZHOT-JGPDYZAISA-L
XLogP18.23
TPSA281.48 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds16
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001893.17
LogP ≤ 518.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride with MolForge

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Related Compounds

CID 161556056
CID 161556056
CID 162010252
CID 162010252
1-Methyl-4-[2-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridin-3-yl]piperazin-2-one;4-[2-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridin-3-yl]piperazin-2-one
CID 145424808
magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3R)-3-[(6-chloropyrazin-2-yl)amino]piperidine-1-carboxylate;tert-butyl (3R)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;6-imidazo[1,2-a]pyridin-3-yl-N-[(3R)-piperidin-3-yl]pyrazin-2-amine;propane;tributyl(chloro)stannane;tributyl(imidazo[1,2-a]pyridin-3-yl)stannane;chloride
CID 157076354
3-(6-Bromo-2-pyridinyl)-6-chloro-7-methylimidazo[1,2-a]pyridine;tert-butyl 3-aminopyrrolidine-1-carboxylate;tert-butyl 3-[[6-(6-chloro-7-methylimidazo[1,2-a]pyridin-3-yl)-2-pyridinyl]amino]pyrrolidine-1-carboxylate
CID 157272726
(7-bromoimidazo[1,5-a]pyridin-1-yl)methanamine;tert-butyl N-[(7-bromoimidazo[1,5-a]pyridin-1-yl)methyl]carbamate;tert-butyl N-[(7-isocyanoimidazo[1,5-a]pyridin-1-yl)methyl]carbamate;(7-isocyanoimidazo[1,5-a]pyridin-1-yl)methanamine;dihydrochloride
CID 157301174
tert-butyl (3R)-3-aminopiperidine-1-carboxylate;tert-butyl (3R)-3-[[5-fluoro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylate;5-fluoro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine;5-fluoro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-1H-pyrimidin-6-one
CID 157383475
Tert-butyl 4-(6-bromo-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[6-[(10-chloro-8-cyclopentyl-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-yl)amino]-3-pyridinyl]piperazine-1-carboxylate;10-chloro-8-cyclopentyl-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 157569162
8-bromo-6-chloroimidazo[1,5-a]pyridine;(3-bromo-5-chloro-2-pyridinyl)methanamine;N-[(3-bromo-5-chloro-2-pyridinyl)methyl]formamide;tert-butyl 4-(6-chloroimidazo[1,5-a]pyridin-8-yl)-2,2-dimethylpiperazine-1-carboxylate;tert-butyl 2,2-dimethylpiperazine-1-carboxylate;6-chloro-8-(3,3-dimethylpiperidin-1-yl)imidazo[1,5-a]pyridine;1-[4-(6-chloroimidazo[1,5-a]pyridin-8-yl)-2,2-dimethylpiperazin-1-yl]ethanone;methane
CID 157621202
Acetyl chloride;tert-butyl 4-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2,2-dimethylpiperazine-1-carboxylate;tert-butyl 2,2-dimethylpiperazine-1-carboxylate;7-chloro-5-(3,3-dimethylpiperidin-1-yl)imidazo[1,5-a]pyridine;1-[4-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2,2-dimethylpiperazin-1-yl]ethanone;5,7-dichloroimidazo[1,5-a]pyridine;methane;hydrochloride
CID 157786270
Ethyl 4-(6-amino-2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate;ethyl 4-(6-chloro-2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate;methane
CID 157843582
Tert-butyl 3-(2-chloropurin-9-yl)pyrrolidine-1-carboxylate;tert-butyl 3-[2-[2,3-difluoro-4-(4-methylpiperazin-1-yl)anilino]purin-9-yl]pyrrolidine-1-carboxylate;2,3-difluoro-4-(4-methylpiperazin-1-yl)aniline
CID 157859879

Frequently Asked Questions

What is the IUPAC name of magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride?
The IUPAC name of magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride (CID 160756054) is magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride.
What is the SMILES notation for magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride?
The canonical SMILES for magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride is Brc1cnc2ccccn12.CC(C)(C)OC(=O)N1CCC[C@H](N)C1.CC(C)(C)OC(=O)N1CCC[C@H](Nc2cncc(-c3cnc4ccccn34)n2)C1.CCCC[Sn](Cl)(CCCC)CCCC.C[CH-]C.Clc1cncc(-c2cnc3ccccn23)n1.Clc1cncc(Cl)n1.[Cl-].[Mg+2].c1ccn2c(-c3cncc(NC4CCCCC4)n3)cnc2c1.
What is the InChIKey of magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride?
The InChIKey is GBJXYNISHRZHOT-JGPDYZAISA-L. The full InChI is InChI=1S/C21H26N6O2.C17H19N5.C11H7ClN4.C10H20N2O2.C7H5BrN2.C4H2Cl2N2.3C4H9.C3H7.2ClH.Mg.Sn/c1-21(2,3)29-20(28)26-9-6-7-15(14-26)24-18-13-22-11-16(25-18)17-12-23-19-8-4-5-10-27(17)19;1-2-6-13(7-3-1)20-16-12-18-10-14(21-16)15-11-19-17-8-4-5-9-22(15)17;12-10-7-13-5-8(15-10)9-6-14-11-3-1-2-4-16(9)11;1-10(2,3)14-9(13)12-6-4-5-8(11)7-12;8-6-5-9-7-3-1-2-4-10(6)7;5-3-1-7-2-4(6)8-3;3*1-3-4-2;1-3-2;;;;/h4-5,8,10-13,15H,6-7,9,14H2,1-3H3,(H,24,25);4-5,8-13H,1-3,6-7H2,(H,20,21);1-7H;8H,4-7,11H2,1-3H3;1-5H;1-2H;3*1,3-4H2,2H3;3H,1-2H3;2*1H;;/q;;;;;;;;;-1;;;+2;+1/p-2/t15-;;;8-;;;;;;;;;;/m0..0........../s1.
What are the key properties of magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride?
magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride has a molecular weight of 1893.17 g/mol, XLogP of 18.23, 16 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;3-bromoimidazo[1,2-a]pyridine;tert-butyl (3S)-3-aminopiperidine-1-carboxylate;tert-butyl (3S)-3-[(6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-yl)amino]piperidine-1-carboxylate;3-(6-chloropyrazin-2-yl)imidazo[1,2-a]pyridine;N-cyclohexyl-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine;2,6-dichloropyrazine;propane;tributyl(chloro)stannane;chloride is sourced from PubChem (CID 160756054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).