6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile

C99H88Cl4N32 — CID 160620823

IUPAC6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile
SMILESCN1CCC(CCNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)CC1.Cn1ccc(-c2nc(NCCC3CCCCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(NCc3cccnc3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1cnc(CNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)c1
InChIInChI=1S/C26H27ClN8.C26H26ClN7.C24H17ClN8.C23H18ClN9/c1-34-11-6-17(7-12-34)5-10-30-26-22(16-28)31-24(25(32-26)21-8-13-35(2)33-21)19-14-18-4-3-9-29-23(18)20(27)15-19;1-34-13-10-21(33-34)25-24(19-14-18-8-5-11-29-23(18)20(27)15-19)31-22(16-28)26(32-25)30-12-9-17-6-3-2-4-7-17;1-33-9-6-19(32-33)23-22(17-10-16-5-3-8-28-21(16)18(25)11-17)30-20(12-26)24(31-23)29-14-15-4-2-7-27-13-15;1-32-12-16(28-13-32)11-27-23-19(10-25)29-21(22(30-23)18-5-7-33(2)31-18)15-8-14-4-3-6-26-20(14)17(24)9-15/h3-4,8-9,13-15,17H,5-7,10-12H2,1-2H3,(H,30,32);5,8,10-11,13-15,17H,2-4,6-7,9,12H2,1H3,(H,30,32);2-11,13H,14H2,1H3,(H,29,31);3-9,12-13H,11H2,1-2H3,(H,27,30)
InChIKeyRGRHHZDDTMDTSH-UHFFFAOYSA-N
MW1867.83 g/mol
LogP19.35
Rot. Bonds22

About 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile

6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile (PubChem CID 160620823) has the molecular formula C99H88Cl4N32 and a molecular weight of 1867.83 g/mol. Its IUPAC name is 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile
PubChem CID160620823
Molecular FormulaC99H88Cl4N32
Molecular Weight1867.83 g/mol
Exact Mass1864.66
IUPAC Name6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile
SMILESCN1CCC(CCNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)CC1.Cn1ccc(-c2nc(NCCC3CCCCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(NCc3cccnc3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1cnc(CNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)c1
InChIInChI=1S/C26H27ClN8.C26H26ClN7.C24H17ClN8.C23H18ClN9/c1-34-11-6-17(7-12-34)5-10-30-26-22(16-28)31-24(25(32-26)21-8-13-35(2)33-21)19-14-18-4-3-9-29-23(18)20(27)15-19;1-34-13-10-21(33-34)25-24(19-14-18-8-5-11-29-23(18)20(27)15-19)31-22(16-28)26(32-25)30-12-9-17-6-3-2-4-7-17;1-33-9-6-19(32-33)23-22(17-10-16-5-3-8-28-21(16)18(25)11-17)30-20(12-26)24(31-23)29-14-15-4-2-7-27-13-15;1-32-12-16(28-13-32)11-27-23-19(10-25)29-21(22(30-23)18-5-7-33(2)31-18)15-8-14-4-3-6-26-20(14)17(24)9-15/h3-4,8-9,13-15,17H,5-7,10-12H2,1-2H3,(H,30,32);5,8,10-11,13-15,17H,2-4,6-7,9,12H2,1H3,(H,30,32);2-11,13H,14H2,1H3,(H,29,31);3-9,12-13H,11H2,1-2H3,(H,27,30)
InChIKeyRGRHHZDDTMDTSH-UHFFFAOYSA-N
XLogP19.35
TPSA403.19 Ų
H-Bond Donors4
H-Bond Acceptors32
Rotatable Bonds22
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001867.83
LogP ≤ 519.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1032

Analyze 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile with MolForge

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Related Compounds

4-[6-[(6-Aminopyrimidin-4-yl)amino]pyrazolo[4,3-c]pyridin-1-yl]-3,5-dimethylbenzonitrile;3-chloro-5-fluoro-4-[6-[[6-(trifluoromethyl)pyrimidin-4-yl]amino]pyrazolo[4,3-c]pyridin-1-yl]benzonitrile;3-chloro-2-[6-[(6-methylpyrimidin-4-yl)amino]pyrazolo[4,3-c]pyridin-1-yl]benzonitrile
CID 156095215
1-(2-chlorophenyl)-4-propan-2-ylpyrazole;2-chloro-4-propan-2-ylpyridine;1-(2,4-dichlorophenyl)-4-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylcyclohexene;6-ethyl-4-propan-2-yl-1,2,3,6-tetrahydropyridine;4-methyl-1-propan-2-ylcyclohexene;1-propan-2-ylcycloheptene;6-propan-2-ylimidazo[1,5-a]pyridine;4-propan-2-ylisoquinoline;7-propan-2-ylisoquinoline;8-propan-2-ylisoquinoline;3-propan-2-ylpyrazolo[1,5-a]pyridine;2-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;N-(5-propan-2-yl-2-pyridinyl)acetamide;3-propan-2-ylquinoline;4-propan-2-yl-6-(trifluoromethyl)-1,2,3,6-tetrahydropyridine
CID 157476195
5-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;4-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(6-piperazin-1-yl-3-pyridinyl)pyrimidin-2-amine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-(3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
CID 157562477
6-(5-Chloro-3-pyridinyl)-3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-fluoro-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-isocyano-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(6-isocyano-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(5-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(1-propan-2-ylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-6-(1-propylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 157642978
3-N-[2-(azetidin-1-yl)ethyl]-5-(7-chloro-1H-indazol-5-yl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-[(1-methylpiperidin-4-yl)methyl]-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-6-phenyl-3-N-(pyridin-3-ylmethyl)pyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-6-phenyl-3-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-6-phenyl-3-N-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethyl]pyrazine-2,3-diamine
CID 159115619
3-Amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-[8-chloro-4-(trifluoromethyl)quinolin-6-yl]-5-phenylpyrazine-2-carbonitrile;3-amino-6-(4,8-dimethylquinolin-6-yl)-5-phenylpyrazine-2-carbonitrile;3-bromo-5-(8-chloro-4-methylquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine
CID 159201679
4-[[3-Amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazin-2-yl]sulfanylmethyl]benzonitrile;5-(8-chloroquinolin-6-yl)-3-[(4-fluorophenyl)methylsulfanyl]-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylsulfanyl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethylsulfanyl]pyrazin-2-amine
CID 159393245
2-(5-Chloro-2-fluorophenyl)-4-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine;2-(5-chloro-2-fluorophenyl)-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;2-(2-fluorophenyl)-4-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine
CID 160026495
2-(5-Chloro-2-fluorophenyl)-4-[5-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]-3-pyridinyl]-1,8-naphthyridine
CID 160163464
5-(8-chloroquinolin-6-yl)-3-N-[(4-methylpiperazin-1-yl)methyl]-6-(1-methylpyrazol-3-yl)pyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-N-(pyridin-3-ylmethyl)pyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-N-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethyl]pyrazine-2,3-diamine
CID 160202825
4-[[[3-amino-6-(8-chloroquinolin-6-yl)-5-phenylpyrazin-2-yl]amino]methyl]benzonitrile;5-(8-chloroquinolin-6-yl)-3-N-[(4-fluorophenyl)methyl]-6-phenylpyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-3-N-[(1-methylpiperidin-4-yl)methyl]-6-phenylpyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-N-(pyridin-3-ylmethyl)pyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-N-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethyl]pyrazine-2,3-diamine
CID 160471449
2-(5-Chloro-2-fluorophenyl)-4-[5-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]-3-pyridinyl]-1,8-naphthyridine;2-(2-fluorophenyl)-4-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-1,8-naphthyridine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-[5-[1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]-3-pyridinyl]-1,8-naphthyridine
CID 160598509

Frequently Asked Questions

What is the IUPAC name of 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile?
The IUPAC name of 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile (CID 160620823) is 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile.
What is the SMILES notation for 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile?
The canonical SMILES for 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile is CN1CCC(CCNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)CC1.Cn1ccc(-c2nc(NCCC3CCCCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(NCc3cccnc3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1cnc(CNc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)c1.
What is the InChIKey of 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile?
The InChIKey is RGRHHZDDTMDTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27ClN8.C26H26ClN7.C24H17ClN8.C23H18ClN9/c1-34-11-6-17(7-12-34)5-10-30-26-22(16-28)31-24(25(32-26)21-8-13-35(2)33-21)19-14-18-4-3-9-29-23(18)20(27)15-19;1-34-13-10-21(33-34)25-24(19-14-18-8-5-11-29-23(18)20(27)15-19)31-22(16-28)26(32-25)30-12-9-17-6-3-2-4-7-17;1-33-9-6-19(32-33)23-22(17-10-16-5-3-8-28-21(16)18(25)11-17)30-20(12-26)24(31-23)29-14-15-4-2-7-27-13-15;1-32-12-16(28-13-32)11-27-23-19(10-25)29-21(22(30-23)18-5-7-33(2)31-18)15-8-14-4-3-6-26-20(14)17(24)9-15/h3-4,8-9,13-15,17H,5-7,10-12H2,1-2H3,(H,30,32);5,8,10-11,13-15,17H,2-4,6-7,9,12H2,1H3,(H,30,32);2-11,13H,14H2,1H3,(H,29,31);3-9,12-13H,11H2,1-2H3,(H,27,30).
What are the key properties of 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile?
6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile has a molecular weight of 1867.83 g/mol, XLogP of 19.35, 22 rotatable bonds, 4 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-chloroquinolin-6-yl)-3-(2-cyclohexylethylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[(1-methylimidazol-4-yl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-3-[2-(1-methylpiperidin-4-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(pyridin-3-ylmethylamino)pyrazine-2-carbonitrile is sourced from PubChem (CID 160620823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).