3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile

C101H69Cl6N41O3S3 — CID 161259434

IUPAC3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile
SMILESCc1cc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)on1.Cc1coc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1csc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)oc1C.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)sc1C.Cc1sc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)c(C)c1C
InChIInChI=1S/C19H15ClN6S.C17H12ClN7O.C17H12ClN7S.2C16H10ClN7O.C16H10ClN7S/c1-8-9(2)18(27-10(8)3)17-16(24-14(6-21)19(22)25-17)11-4-12-7-23-26-15(12)13(20)5-11;2*1-7-8(2)26-17(22-7)15-14(23-12(5-19)16(20)24-15)9-3-10-6-21-25-13(10)11(18)4-9;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8;1-7-2-12(25-24-7)15-14(21-11(5-18)16(19)22-15)8-3-9-6-20-23-13(9)10(17)4-8;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8/h4-5,7H,1-3H3,(H2,22,25)(H,23,26);2*3-4,6H,1-2H3,(H2,20,24)(H,21,25);2-3,5-6H,1H3,(H2,19,23)(H,20,24);2-4,6H,1H3,(H2,19,22)(H,20,23);2-3,5-6H,1H3,(H2,19,23)(H,20,24)
InChIKeyVCIYWPDWQVXGJI-UHFFFAOYSA-N
MW2213.87 g/mol
LogP21.79
Rot. Bonds12

About 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile

3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile (PubChem CID 161259434) has the molecular formula C101H69Cl6N41O3S3 and a molecular weight of 2213.87 g/mol. Its IUPAC name is 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile
PubChem CID161259434
Molecular FormulaC101H69Cl6N41O3S3
Molecular Weight2213.87 g/mol
Exact Mass2209.38
IUPAC Name3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile
SMILESCc1cc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)on1.Cc1coc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1csc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)oc1C.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)sc1C.Cc1sc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)c(C)c1C
InChIInChI=1S/C19H15ClN6S.C17H12ClN7O.C17H12ClN7S.2C16H10ClN7O.C16H10ClN7S/c1-8-9(2)18(27-10(8)3)17-16(24-14(6-21)19(22)25-17)11-4-12-7-23-26-15(12)13(20)5-11;2*1-7-8(2)26-17(22-7)15-14(23-12(5-19)16(20)24-15)9-3-10-6-21-25-13(10)11(18)4-9;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8;1-7-2-12(25-24-7)15-14(21-11(5-18)16(19)22-15)8-3-9-6-20-23-13(9)10(17)4-8;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8/h4-5,7H,1-3H3,(H2,22,25)(H,23,26);2*3-4,6H,1-2H3,(H2,20,24)(H,21,25);2-3,5-6H,1H3,(H2,19,23)(H,20,24);2-4,6H,1H3,(H2,19,22)(H,20,23);2-3,5-6H,1H3,(H2,19,23)(H,20,24)
InChIKeyVCIYWPDWQVXGJI-UHFFFAOYSA-N
XLogP21.79
TPSA729.49 Ų
H-Bond Donors12
H-Bond Acceptors41
Rotatable Bonds12
Heavy Atoms154
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002213.87
LogP ≤ 521.79
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1041

Analyze 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile?
The IUPAC name of 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile (CID 161259434) is 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile?
The canonical SMILES for 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile is Cc1cc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)on1.Cc1coc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1csc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)n1.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)oc1C.Cc1nc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)sc1C.Cc1sc(-c2nc(N)c(C#N)nc2-c2cc(Cl)c3[nH]ncc3c2)c(C)c1C.
What is the InChIKey of 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile?
The InChIKey is VCIYWPDWQVXGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN6S.C17H12ClN7O.C17H12ClN7S.2C16H10ClN7O.C16H10ClN7S/c1-8-9(2)18(27-10(8)3)17-16(24-14(6-21)19(22)25-17)11-4-12-7-23-26-15(12)13(20)5-11;2*1-7-8(2)26-17(22-7)15-14(23-12(5-19)16(20)24-15)9-3-10-6-21-25-13(10)11(18)4-9;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8;1-7-2-12(25-24-7)15-14(21-11(5-18)16(19)22-15)8-3-9-6-20-23-13(9)10(17)4-8;1-7-6-25-16(21-7)14-13(22-11(4-18)15(19)23-14)8-2-9-5-20-24-12(9)10(17)3-8/h4-5,7H,1-3H3,(H2,22,25)(H,23,26);2*3-4,6H,1-2H3,(H2,20,24)(H,21,25);2-3,5-6H,1H3,(H2,19,23)(H,20,24);2-4,6H,1H3,(H2,19,22)(H,20,23);2-3,5-6H,1H3,(H2,19,23)(H,20,24).
What are the key properties of 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile?
3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile has a molecular weight of 2213.87 g/mol, XLogP of 21.79, 12 rotatable bonds, 12 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3-methyl-1,2-oxazol-5-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-oxazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carbonitrile;3-amino-6-(7-chloro-1H-indazol-5-yl)-5-(3,4,5-trimethylthiophen-2-yl)pyrazine-2-carbonitrile is sourced from PubChem (CID 161259434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).