3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine

C90H70Cl3FN30 — CID 160708218

IUPAC3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine
SMILESCc1[nH]nc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2c(Cl)cc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1ccnc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccc(F)cc3)cc12
InChIInChI=1S/C21H13ClFN5.C19H13ClN6.C18H15N5.C16H14ClN7.C16H15N7/c1-11-6-7-26-20-15(11)8-13(9-16(20)22)19-18(12-2-4-14(23)5-3-12)28-21(25)17(10-24)27-19;1-10-13-7-12(8-14(20)18(13)26-25-10)17-16(11-5-3-2-4-6-11)24-19(22)15(9-21)23-17;1-11-14-9-13(7-8-15(14)23-22-11)17-18(21-16(19)10-20-17)12-5-3-2-4-6-12;1-8-10-5-9(6-11(17)15(10)22-21-8)14-16(20-13(18)7-19-14)12-3-4-24(2)23-12;1-9-11-7-10(3-4-12(11)21-20-9)15-16(19-14(17)8-18-15)13-5-6-23(2)22-13/h2-9H,1H3,(H2,25,28);2-8H,1H3,(H2,22,24)(H,25,26);2-10H,1H3,(H2,19,21)(H,22,23);3-7H,1-2H3,(H2,18,20)(H,21,22);3-8H,1-2H3,(H2,17,19)(H,20,21)
InChIKeyRRMWYXYMTLMSDS-UHFFFAOYSA-N
MW1697.12 g/mol
LogP17.87
Rot. Bonds10

About 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine

3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine (PubChem CID 160708218) has the molecular formula C90H70Cl3FN30 and a molecular weight of 1697.12 g/mol. Its IUPAC name is 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine.

Molecular Properties

Compound Name3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine
PubChem CID160708218
Molecular FormulaC90H70Cl3FN30
Molecular Weight1697.12 g/mol
Exact Mass1694.54
IUPAC Name3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine
SMILESCc1[nH]nc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2c(Cl)cc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1ccnc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccc(F)cc3)cc12
InChIInChI=1S/C21H13ClFN5.C19H13ClN6.C18H15N5.C16H14ClN7.C16H15N7/c1-11-6-7-26-20-15(11)8-13(9-16(20)22)19-18(12-2-4-14(23)5-3-12)28-21(25)17(10-24)27-19;1-10-13-7-12(8-14(20)18(13)26-25-10)17-16(11-5-3-2-4-6-11)24-19(22)15(9-21)23-17;1-11-14-9-13(7-8-15(14)23-22-11)17-18(21-16(19)10-20-17)12-5-3-2-4-6-12;1-8-10-5-9(6-11(17)15(10)22-21-8)14-16(20-13(18)7-19-14)12-3-4-24(2)23-12;1-9-11-7-10(3-4-12(11)21-20-9)15-16(19-14(17)8-18-15)13-5-6-23(2)22-13/h2-9H,1H3,(H2,25,28);2-8H,1H3,(H2,22,24)(H,25,26);2-10H,1H3,(H2,19,21)(H,22,23);3-7H,1-2H3,(H2,18,20)(H,21,22);3-8H,1-2H3,(H2,17,19)(H,20,21)
InChIKeyRRMWYXYMTLMSDS-UHFFFAOYSA-N
XLogP17.87
TPSA469.83 Ų
H-Bond Donors9
H-Bond Acceptors26
Rotatable Bonds10
Heavy Atoms124
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001697.12
LogP ≤ 517.87
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1026

Analyze 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine?
The IUPAC name of 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine (CID 160708218) is 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine.
What is the SMILES notation for 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine?
The canonical SMILES for 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine is Cc1[nH]nc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2c(Cl)cc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccccc3)cc12.Cc1[nH]nc2ccc(-c3ncc(N)nc3-c3ccn(C)n3)cc12.Cc1ccnc2c(Cl)cc(-c3nc(C#N)c(N)nc3-c3ccc(F)cc3)cc12.
What is the InChIKey of 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine?
The InChIKey is RRMWYXYMTLMSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13ClFN5.C19H13ClN6.C18H15N5.C16H14ClN7.C16H15N7/c1-11-6-7-26-20-15(11)8-13(9-16(20)22)19-18(12-2-4-14(23)5-3-12)28-21(25)17(10-24)27-19;1-10-13-7-12(8-14(20)18(13)26-25-10)17-16(11-5-3-2-4-6-11)24-19(22)15(9-21)23-17;1-11-14-9-13(7-8-15(14)23-22-11)17-18(21-16(19)10-20-17)12-5-3-2-4-6-12;1-8-10-5-9(6-11(17)15(10)22-21-8)14-16(20-13(18)7-19-14)12-3-4-24(2)23-12;1-9-11-7-10(3-4-12(11)21-20-9)15-16(19-14(17)8-18-15)13-5-6-23(2)22-13/h2-9H,1H3,(H2,25,28);2-8H,1H3,(H2,22,24)(H,25,26);2-10H,1H3,(H2,19,21)(H,22,23);3-7H,1-2H3,(H2,18,20)(H,21,22);3-8H,1-2H3,(H2,17,19)(H,20,21).
What are the key properties of 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine?
3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine has a molecular weight of 1697.12 g/mol, XLogP of 17.87, 10 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(7-chloro-3-methyl-2H-indazol-5-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(8-chloro-4-methylquinolin-6-yl)-5-(4-fluorophenyl)pyrazine-2-carbonitrile;5-(7-chloro-3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(3-methyl-2H-indazol-5-yl)-6-phenylpyrazin-2-amine is sourced from PubChem (CID 160708218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).