2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine

C118H127Cl2N31O3S4 — CID 157328725

IUPAC2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESC.CCOC(=O)c1csc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.Cc1cccc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.NC(=O)c1cnc(N[C@@H]2CCCNC2)c2nc(-c3ccc(Cl)cc3)cn12.Nc1ncc(-c2cc(-c3ccc(Cl)cc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2cc(-c3ccccc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2sccc2-c2ccccc2)n2cc(C3CCCNC3)nc12
InChIInChI=1S/C21H20ClN5S.2C21H21N5S.C18H19ClN6O.C18H21N5O2S.C18H21N5.CH4/c22-16-5-3-13(4-6-16)15-8-19(28-12-15)18-10-25-20(23)21-26-17(11-27(18)21)14-2-1-7-24-9-14;22-20-21-25-17(15-7-4-9-23-11-15)13-26(21)18(12-24-20)19-16(8-10-27-19)14-5-2-1-3-6-14;22-20-21-25-17(15-7-4-8-23-10-15)12-26(21)18(11-24-20)19-9-16(13-27-19)14-5-2-1-3-6-14;19-12-5-3-11(4-6-12)14-10-25-15(16(20)26)9-22-17(18(25)24-14)23-13-2-1-7-21-8-13;1-2-25-18(24)12-6-15(26-10-12)14-8-21-16(19)17-22-13(9-23(14)17)11-4-3-5-20-7-11;1-12-4-2-5-13(8-12)16-10-21-17(19)18-22-15(11-23(16)18)14-6-3-7-20-9-14;/h3-6,8,10-12,14,24H,1-2,7,9H2,(H2,23,25);1-3,5-6,8,10,12-13,15,23H,4,7,9,11H2,(H2,22,24);1-3,5-6,9,11-13,15,23H,4,7-8,10H2,(H2,22,24);3-6,9-10,13,21H,1-2,7-8H2,(H2,20,26)(H,22,23);6,8-11,20H,2-5,7H2,1H3,(H2,19,21);2,4-5,8,10-11,14,20H,3,6-7,9H2,1H3,(H2,19,21);1H4/t14-;;15-;13-;11-;14-;/m0.0100./s1
InChIKeyBFAKJNJBGPFVOE-PAABYKGESA-N
MW2226.70 g/mol
LogP21.56
Rot. Bonds19

About 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine

2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 157328725) has the molecular formula C118H127Cl2N31O3S4 and a molecular weight of 2226.70 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID157328725
Molecular FormulaC118H127Cl2N31O3S4
Molecular Weight2226.70 g/mol
Exact Mass2223.90
IUPAC Name2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESC.CCOC(=O)c1csc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.Cc1cccc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.NC(=O)c1cnc(N[C@@H]2CCCNC2)c2nc(-c3ccc(Cl)cc3)cn12.Nc1ncc(-c2cc(-c3ccc(Cl)cc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2cc(-c3ccccc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2sccc2-c2ccccc2)n2cc(C3CCCNC3)nc12
InChIInChI=1S/C21H20ClN5S.2C21H21N5S.C18H19ClN6O.C18H21N5O2S.C18H21N5.CH4/c22-16-5-3-13(4-6-16)15-8-19(28-12-15)18-10-25-20(23)21-26-17(11-27(18)21)14-2-1-7-24-9-14;22-20-21-25-17(15-7-4-9-23-11-15)13-26(21)18(12-24-20)19-16(8-10-27-19)14-5-2-1-3-6-14;22-20-21-25-17(15-7-4-8-23-10-15)12-26(21)18(11-24-20)19-9-16(13-27-19)14-5-2-1-3-6-14;19-12-5-3-11(4-6-12)14-10-25-15(16(20)26)9-22-17(18(25)24-14)23-13-2-1-7-21-8-13;1-2-25-18(24)12-6-15(26-10-12)14-8-21-16(19)17-22-13(9-23(14)17)11-4-3-5-20-7-11;1-12-4-2-5-13(8-12)16-10-21-17(19)18-22-15(11-23(16)18)14-6-3-7-20-9-14;/h3-6,8,10-12,14,24H,1-2,7,9H2,(H2,23,25);1-3,5-6,8,10,12-13,15,23H,4,7,9,11H2,(H2,22,24);1-3,5-6,9,11-13,15,23H,4,7-8,10H2,(H2,22,24);3-6,9-10,13,21H,1-2,7-8H2,(H2,20,26)(H,22,23);6,8-11,20H,2-5,7H2,1H3,(H2,19,21);2,4-5,8,10-11,14,20H,3,6-7,9H2,1H3,(H2,19,21);1H4/t14-;;15-;13-;11-;14-;/m0.0100./s1
InChIKeyBFAKJNJBGPFVOE-PAABYKGESA-N
XLogP21.56
TPSA464.84 Ų
H-Bond Donors13
H-Bond Acceptors37
Rotatable Bonds19
Heavy Atoms158
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002226.70
LogP ≤ 521.56
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1037

Analyze 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine with MolForge

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Related Compounds

4-[[6-bromo-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-N-ethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-5-carboxamide;4-[[2-(4-chlorophenyl)-6-morpholin-4-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-5-carboxylic acid;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 157792046
Tert-butyl 8-[[(6-pyrrolidin-1-ylpyridine-3-carbonyl)amino]carbamoyl]-2-thiophen-3-ylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 6-chloropyridine-3-carboxylate;ethyl 6-pyrrolidin-1-ylpyridine-3-carboxylate;6-pyrrolidin-1-ylpyridine-3-carbohydrazide
CID 157896753
5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
CID 158642531
N-[(3R)-3-[4-[(2-benzamidoacetyl)-(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]-2,6-dichloro-4-methylpyridine-3-carboxamide;2,6-dichloro-N-[(3R)-3-[4-[(2-imidazol-1-ylacetyl)-(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]-4-methylpyridine-3-carboxamide;ethyl 4-[[[1-[(2R)-4-[(6-chloro-2,4-dimethylpyridine-3-carbonyl)amino]butan-2-yl]piperidin-4-yl]-(thiophen-3-ylmethyl)carbamoyl]amino]benzoate;methyl 3-[[[1-[(2R)-4-[(6-chloro-2,4-dimethylpyridine-3-carbonyl)amino]butan-2-yl]piperidin-4-yl]-(thiophen-3-ylmethyl)carbamoyl]amino]benzoate
CID 160108597
4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-N,N-diethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide;2-(4-chlorophenyl)-N-ethyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridine-5-carboxamide;4-[[2-(4-chlorophenyl)-6-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[2-(4-chlorophenyl)-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-yl]butan-1-one;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 160860225
N-[(3R)-3-[4-[[2-(carbamoylamino)acetyl]-(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]-2,6-dichloro-4-methylpyridine-3-carboxamide;4-[[[1-[(2R)-4-[(6-chloro-2,4-dimethylpyridine-3-carbonyl)amino]butan-2-yl]piperidin-4-yl]-(thiophen-3-ylmethyl)carbamoyl]amino]benzoic acid;2,6-dichloro-N-[(3R)-3-[4-[(2-imidazol-1-ylacetyl)-(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]-4-methylpyridine-3-carboxamide;ethyl 4-[[[1-[(2R)-4-[(6-chloro-2,4-dimethylpyridine-3-carbonyl)amino]butan-2-yl]piperidin-4-yl]-(thiophen-3-ylmethyl)carbamoyl]amino]benzoate;methyl 3-[[[1-[(2R)-4-[(6-chloro-2,4-dimethylpyridine-3-carbonyl)amino]butan-2-yl]piperidin-4-yl]-(thiophen-3-ylmethyl)carbamoyl]amino]benzoate
CID 161158583
5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
CID 161753659
2-(5-chlorothiophen-2-yl)-N-methyl-3-[(1S,3R)-3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]imidazo[4,5-b]pyridine-6-carboxamide;N,5-dimethyl-N-[(1S,3R)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)cyclohexyl]thiophene-2-carboxamide;ethyl 1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazole-5-carboxylate;bis(ethyl 1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazole-5-carboxylate);N-methyl-3-[(1S,3S)-3-[(5-phenylthiophene-2-carbonyl)amino]cyclohexyl]-2-pyridin-2-ylimidazo[4,5-b]pyridine-6-carboxamide;5-methyl-N-[(1R,3S)-3-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)cyclohexyl]thiophene-2-carboxamide;3-[(1R,3S)-3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]-2-pyridin-2-ylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 167568549
2-(5-chlorothiophen-2-yl)-N-methyl-3-[(1S,3R)-3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]imidazo[4,5-b]pyridine-6-carboxamide;N,5-dimethyl-N-[(1S,3R)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)cyclohexyl]thiophene-2-carboxamide;ethyl 1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylbenzimidazole-5-carboxylate;N-methyl-2-phenyl-1-[(1S,3S)-3-[(5-phenylthiophene-2-carbonyl)amino]cyclohexyl]pyrrolo[2,3-b]pyridine-5-carboxamide;5-methyl-N-[(1R,3S)-3-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)cyclohexyl]thiophene-2-carboxamide;3-[(1R,3S)-3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]-2-pyridin-2-ylimidazo[4,5-c]pyridine-6-carboxylic acid
CID 167590932
2-[(1R,3S)-3-(6-fluoro-2-pyridin-2-ylimidazo[4,5-c]pyridin-1-yl)cyclohexyl]-1-(5-methylthiophen-2-yl)ethanone;N-methyl-3-[3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide;N-methyl-3-[(1S,3R)-3-[(5-methylthiophene-2-carbonyl)amino]cyclohexyl]-2-pyridin-2-ylimidazo[4,5-b]pyridine-6-carboxamide;methyl 1-[(1R,3S)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]-2-pyridin-2-ylimidazo[4,5-b]pyridine-5-carboxylate;methyl 1-[(1S,3R)-3-(2-oxo-2-thiophen-2-ylethyl)cyclohexyl]-2-pyridin-2-ylimidazo[4,5-b]pyridine-5-carboxylate
CID 167645555

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine (CID 157328725) is 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine is C.CCOC(=O)c1csc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.Cc1cccc(-c2cnc(N)c3nc([C@H]4CCCNC4)cn23)c1.NC(=O)c1cnc(N[C@@H]2CCCNC2)c2nc(-c3ccc(Cl)cc3)cn12.Nc1ncc(-c2cc(-c3ccc(Cl)cc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2cc(-c3ccccc3)cs2)n2cc([C@H]3CCCNC3)nc12.Nc1ncc(-c2sccc2-c2ccccc2)n2cc(C3CCCNC3)nc12.
What is the InChIKey of 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is BFAKJNJBGPFVOE-PAABYKGESA-N. The full InChI is InChI=1S/C21H20ClN5S.2C21H21N5S.C18H19ClN6O.C18H21N5O2S.C18H21N5.CH4/c22-16-5-3-13(4-6-16)15-8-19(28-12-15)18-10-25-20(23)21-26-17(11-27(18)21)14-2-1-7-24-9-14;22-20-21-25-17(15-7-4-9-23-11-15)13-26(21)18(12-24-20)19-16(8-10-27-19)14-5-2-1-3-6-14;22-20-21-25-17(15-7-4-8-23-10-15)12-26(21)18(11-24-20)19-9-16(13-27-19)14-5-2-1-3-6-14;19-12-5-3-11(4-6-12)14-10-25-15(16(20)26)9-22-17(18(25)24-14)23-13-2-1-7-21-8-13;1-2-25-18(24)12-6-15(26-10-12)14-8-21-16(19)17-22-13(9-23(14)17)11-4-3-5-20-7-11;1-12-4-2-5-13(8-12)16-10-21-17(19)18-22-15(11-23(16)18)14-6-3-7-20-9-14;/h3-6,8,10-12,14,24H,1-2,7,9H2,(H2,23,25);1-3,5-6,8,10,12-13,15,23H,4,7,9,11H2,(H2,22,24);1-3,5-6,9,11-13,15,23H,4,7-8,10H2,(H2,22,24);3-6,9-10,13,21H,1-2,7-8H2,(H2,20,26)(H,22,23);6,8-11,20H,2-5,7H2,1H3,(H2,19,21);2,4-5,8,10-11,14,20H,3,6-7,9H2,1H3,(H2,19,21);1H4/t14-;;15-;13-;11-;14-;/m0.0100./s1.
What are the key properties of 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine?
2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 2226.70 g/mol, XLogP of 21.56, 19 rotatable bonds, 13 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-8-[[(3R)-piperidin-3-yl]amino]imidazo[1,2-a]pyrazine-5-carboxamide;5-[4-(4-chlorophenyl)thiophen-2-yl]-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;ethyl 5-[8-amino-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-5-yl]thiophene-3-carboxylate;methane;5-(3-methylphenyl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine;5-(3-phenylthiophen-2-yl)-2-piperidin-3-ylimidazo[1,2-a]pyrazin-8-amine;5-(4-phenylthiophen-2-yl)-2-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 157328725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).