6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile

C110H89Cl5N36O2 — CID 157221319

IUPAC6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile
SMILESCn1ccc(-c2nc(NC3CCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(Nc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)n1.N#Cc1nc(-c2cc(Cl)c3ccccc3c2)c(-c2ccccc2)nc1NC1CC1
InChIInChI=1S/C24H17ClN4.C23H20ClN7O.C22H16ClN9.C21H19ClN8O.C20H17ClN8/c25-20-13-17(12-16-8-4-5-9-19(16)20)23-22(15-6-2-1-3-7-15)29-24(21(14-26)28-23)27-18-10-11-18;1-31-8-4-18(30-31)22-21(15-11-14-3-2-7-26-20(14)17(24)12-15)28-19(13-25)23(29-22)27-16-5-9-32-10-6-16;1-31-8-5-16(29-31)21-20(14-10-13-4-3-7-25-19(13)15(23)11-14)26-17(12-24)22(28-21)27-18-6-9-32(2)30-18;1-30-5-2-16(29-30)20-19(12-8-13-11-24-28-18(13)15(22)9-12)26-17(10-23)21(27-20)25-14-3-6-31-7-4-14;1-29-6-5-15(28-29)19-18(11-7-12-10-23-27-17(12)14(21)8-11)25-16(9-22)20(26-19)24-13-3-2-4-13/h1-9,12-13,18H,10-11H2,(H,27,29);2-4,7-8,11-12,16H,5-6,9-10H2,1H3,(H,27,29);3-11H,1-2H3,(H,27,28,30);2,5,8-9,11,14H,3-4,6-7H2,1H3,(H,24,28)(H,25,27);5-8,10,13H,2-4H2,1H3,(H,23,27)(H,24,26)
InChIKeyATAGRILMWLRQAU-UHFFFAOYSA-N
MW2124.44 g/mol
LogP21.81
Rot. Bonds20

About 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile

6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile (PubChem CID 157221319) has the molecular formula C110H89Cl5N36O2 and a molecular weight of 2124.44 g/mol. Its IUPAC name is 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile
PubChem CID157221319
Molecular FormulaC110H89Cl5N36O2
Molecular Weight2124.44 g/mol
Exact Mass2120.64
IUPAC Name6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile
SMILESCn1ccc(-c2nc(NC3CCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(Nc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)n1.N#Cc1nc(-c2cc(Cl)c3ccccc3c2)c(-c2ccccc2)nc1NC1CC1
InChIInChI=1S/C24H17ClN4.C23H20ClN7O.C22H16ClN9.C21H19ClN8O.C20H17ClN8/c25-20-13-17(12-16-8-4-5-9-19(16)20)23-22(15-6-2-1-3-7-15)29-24(21(14-26)28-23)27-18-10-11-18;1-31-8-4-18(30-31)22-21(15-11-14-3-2-7-26-20(14)17(24)12-15)28-19(13-25)23(29-22)27-16-5-9-32-10-6-16;1-31-8-5-16(29-31)21-20(14-10-13-4-3-7-25-19(13)15(23)11-14)26-17(12-24)22(28-21)27-18-6-9-32(2)30-18;1-30-5-2-16(29-30)20-19(12-8-13-11-24-28-18(13)15(22)9-12)26-17(10-23)21(27-20)25-14-3-6-31-7-4-14;1-29-6-5-15(28-29)19-18(11-7-12-10-23-27-17(12)14(21)8-11)25-16(9-22)20(26-19)24-13-3-2-4-13/h1-9,12-13,18H,10-11H2,(H,27,29);2-4,7-8,11-12,16H,5-6,9-10H2,1H3,(H,27,29);3-11H,1-2H3,(H,27,28,30);2,5,8-9,11,14H,3-4,6-7H2,1H3,(H,24,28)(H,25,27);5-8,10,13H,2-4H2,1H3,(H,23,27)(H,24,26)
InChIKeyATAGRILMWLRQAU-UHFFFAOYSA-N
XLogP21.81
TPSA498.70 Ų
H-Bond Donors7
H-Bond Acceptors36
Rotatable Bonds20
Heavy Atoms153
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002124.44
LogP ≤ 521.81
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1036

Analyze 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile with MolForge

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Related Compounds

1-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-phenylpyrazin-2-yl]-3-cyclopropylurea;6-(7-chloro-1H-indazol-5-yl)-5-phenyl-3-(2,2,2-trifluoroethylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(3-methylbut-2-enylamino)-5-phenylpyrazine-2-carbonitrile;1-[5-(8-chloroquinolin-6-yl)-3-cyano-6-phenylpyrazin-2-yl]-3-methylurea;6-(8-chloroquinolin-6-yl)-5-phenyl-3-(2,2,2-trifluoroethylamino)pyrazine-2-carbonitrile
CID 161562913
6-[5-amino-3-(1-methylpyrazol-3-yl)-6-prop-1-en-2-ylpyrazin-2-yl]-8-chloro-2H-isoquinolin-1-one;5-(7-chloro-1H-indazol-5-yl)-3-cyclobutyl-6-(3-methylpyrazol-1-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-cyclopropyl-6-(3-methylpyrazol-1-yl)pyrazin-2-amine;3-cyclobutyl-6-(3-methylpyrazol-1-yl)-5-quinolin-6-ylpyrazin-2-amine;3-cyclopropyl-6-pyridin-1-ium-1-yl-5-quinolin-6-ylpyrazin-2-amine
CID 157131091
tert-butyl N-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]carbamate;cyclopentyl N-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]carbamate;cyclopropyl N-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]carbamate;oxan-4-ylmethyl N-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]carbamate;propan-2-yl N-[5-(7-chloro-1H-indazol-5-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]carbamate
CID 157156330
3-chloro-N-cyclobutyl-N-methyl-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)isoquinolin-1-amine;1-[3-(dimethylamino)pyrrolidin-1-yl]-N-(5H-pyrrolo[3,4-b]pyridin-7-yl)isoquinolin-6-amine;N-(2-methoxyethyl)-3-methyl-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)isoquinolin-1-amine;3-methyl-1-piperidin-1-yl-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)isoquinoline;3-methyl-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)-1-pyrrolidin-1-ylisoquinoline;N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-[1,2,4]triazolo[3,4-a]isoquinolin-8-amine
CID 157274286
3-But-2-ynyl-5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-cyclobutyl-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-cyclopropyl-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-naphthalen-2-ylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)-3-phenylpyrazin-2-amine
CID 157325849
3-(benzylamino)-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;N-[5-(8-chloroquinolin-6-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]acetamide;6-(8-chloroquinolin-6-yl)-3-[(4-methylphenyl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(2-phenylethylamino)pyrazine-2-carbonitrile
CID 157383580
3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(2H-triazol-4-yl)pyrazine-2-carbonitrile;3-amino-5-(1,4-dimethylpyrrol-3-yl)-6-quinolin-6-ylpyrazine-2-carbonitrile;3-amino-6-(7-fluoro-1H-indazol-5-yl)-5-(1H-1,2,4-triazol-5-yl)pyrazine-2-carbonitrile;3-amino-5-(4-methyl-1H-pyrrol-3-yl)-6-quinolin-6-ylpyrazine-2-carbonitrile;3-amino-5-(5-methyl-1H-pyrrol-3-yl)-6-quinolin-6-ylpyrazine-2-carbonitrile
CID 157392492
5-(7-chloro-1H-indazol-5-yl)-3-N-(cyclobutylmethyl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(cyclohexylmethyl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(2-cyclopentylethyl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(cyclopropylmethyl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-[2-(diethylamino)ethyl]-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-[(3-methylimidazolidin-1-yl)methyl]-6-phenylpyrazine-2,3-diamine
CID 157396926
6-(8-Chloroquinolin-6-yl)-3-[2-(3-methyl-1,3-oxazinan-6-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[2-(1-methylpyrrol-3-yl)ethylamino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(2-pyridin-4-ylethylamino)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(2-pyrimidin-4-ylethylamino)pyrazine-2-carbonitrile
CID 157591099
3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethylpyridazin-3-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(5,6-dimethylpyridazin-3-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethylpyrimidin-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(6-methylpyrazin-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methylpyridazin-3-yl)pyrazine-2-carbonitrile;3-amino-6-(7-methyl-1H-indazol-5-yl)-5-(5-methylpyridazin-3-yl)pyrazine-2-carbonitrile
CID 157627443
6-(7-chloro-1H-indazol-5-yl)-3-[2-(3-methyl-1,3-oxazinan-6-yl)ethylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-[2-(1-methylpyrrol-3-yl)ethylamino]pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(2-pyridin-4-ylethylamino)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(2-pyrimidin-4-ylethylamino)pyrazine-2-carbonitrile
CID 157888094
5-(7-chloro-1H-indazol-5-yl)-3-N,6-diphenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(1-methylazetidin-3-yl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(1-methylpiperidin-4-yl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(1-methylpyrrolidin-3-yl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-3-N-(1-methylpyrrol-3-yl)-6-phenylpyrazine-2,3-diamine;5-(7-chloro-1H-indazol-5-yl)-6-phenyl-3-N-pyridin-3-ylpyrazine-2,3-diamine
CID 158532425

Frequently Asked Questions

What is the IUPAC name of 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile?
The IUPAC name of 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile (CID 157221319) is 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile.
What is the SMILES notation for 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile?
The canonical SMILES for 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile is Cn1ccc(-c2nc(NC3CCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cn1ccc(-c2nc(NC3CCOCC3)c(C#N)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(Nc2nc(-c3ccn(C)n3)c(-c3cc(Cl)c4ncccc4c3)nc2C#N)n1.N#Cc1nc(-c2cc(Cl)c3ccccc3c2)c(-c2ccccc2)nc1NC1CC1.
What is the InChIKey of 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile?
The InChIKey is ATAGRILMWLRQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17ClN4.C23H20ClN7O.C22H16ClN9.C21H19ClN8O.C20H17ClN8/c25-20-13-17(12-16-8-4-5-9-19(16)20)23-22(15-6-2-1-3-7-15)29-24(21(14-26)28-23)27-18-10-11-18;1-31-8-4-18(30-31)22-21(15-11-14-3-2-7-26-20(14)17(24)12-15)28-19(13-25)23(29-22)27-16-5-9-32-10-6-16;1-31-8-5-16(29-31)21-20(14-10-13-4-3-7-25-19(13)15(23)11-14)26-17(12-24)22(28-21)27-18-6-9-32(2)30-18;1-30-5-2-16(29-30)20-19(12-8-13-11-24-28-18(13)15(22)9-12)26-17(10-23)21(27-20)25-14-3-6-31-7-4-14;1-29-6-5-15(28-29)19-18(11-7-12-10-23-27-17(12)14(21)8-11)25-16(9-22)20(26-19)24-13-3-2-4-13/h1-9,12-13,18H,10-11H2,(H,27,29);2-4,7-8,11-12,16H,5-6,9-10H2,1H3,(H,27,29);3-11H,1-2H3,(H,27,28,30);2,5,8-9,11,14H,3-4,6-7H2,1H3,(H,24,28)(H,25,27);5-8,10,13H,2-4H2,1H3,(H,23,27)(H,24,26).
What are the key properties of 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile?
6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile has a molecular weight of 2124.44 g/mol, XLogP of 21.81, 20 rotatable bonds, 7 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-chloro-1H-indazol-5-yl)-3-(cyclobutylamino)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(7-chloro-1H-indazol-5-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile;6-(4-chloronaphthalen-2-yl)-3-(cyclopropylamino)-5-phenylpyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-[(1-methylpyrazol-3-yl)amino]pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(oxan-4-ylamino)pyrazine-2-carbonitrile is sourced from PubChem (CID 157221319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).