3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine

C87H68Cl4FN31O4 — CID 159614276

About 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine

3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine (PubChem CID 159614276) has the molecular formula C87H68Cl4FN31O4 and a molecular weight of 1772.52 g/mol. Its IUPAC name is 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine.

Molecular Properties

• Compound Name: 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine
• PubChem CID: 159614276
• Molecular Formula: C87H68Cl4FN31O4
• Molecular Weight: 1772.52 g/mol
• Exact Mass: 1769.48
• IUPAC Name: 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine
• SMILES: COc1nc(-c2cc(Cl)c3ncccc3c2)c(-c2ccn(C)n2)nc1N.Cc1ccn(-c2nc(N)c(=O)[nH]c2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)c(=O)[nH]c2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)c(C(N)=O)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)cnc2-c2cc(F)c3ncccc3c2)n1
• InChI: InChI=1S/C18H14ClN7O.C18H15ClN6O.2C17H13ClN6O.C17H13FN6/c1-26-6-4-12(25-26)15-14(23-16(18(21)27)17(20)24-15)10-7-9-3-2-5-22-13(9)11(19)8-10;1-25-7-5-13(24-25)16-15(23-18(26-2)17(20)22-16)11-8-10-4-3-6-21-14(10)12(19)9-11;1-24-6-4-12(23-24)15-14(22-17(25)16(19)21-15)10-7-9-3-2-5-20-13(9)11(18)8-10;1-9-4-6-24(23-9)16-14(21-17(25)15(19)22-16)11-7-10-3-2-5-20-13(10)12(18)8-11;1-24-6-4-13(23-24)17-16(21-9-14(19)22-17)11-7-10-3-2-5-20-15(10)12(18)8-11/h2-8H,1H3,(H2,20,24)(H2,21,27);3-9H,1-2H3,(H2,20,22);2-8H,1H3,(H2,19,21)(H,22,25);2-8H,1H3,(H2,19,22)(H,21,25);2-9H,1H3,(H2,19,22)
• InChIKey: MNBWCNIFDXXZPY-UHFFFAOYSA-N
• XLogP: 13.91
• TPSA: 504.81 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 32
• Rotatable Bonds: 12
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1772.52
LogP ≤ 5	13.91
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine?

The IUPAC name of 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine (CID 159614276) is 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine.

What is the SMILES notation for 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine?

The canonical SMILES for 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine is COc1nc(-c2cc(Cl)c3ncccc3c2)c(-c2ccn(C)n2)nc1N.Cc1ccn(-c2nc(N)c(=O)[nH]c2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)c(=O)[nH]c2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)c(C(N)=O)nc2-c2cc(Cl)c3ncccc3c2)n1.Cn1ccc(-c2nc(N)cnc2-c2cc(F)c3ncccc3c2)n1.

What is the InChIKey of 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine?

The InChIKey is MNBWCNIFDXXZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN7O.C18H15ClN6O.2C17H13ClN6O.C17H13FN6/c1-26-6-4-12(25-26)15-14(23-16(18(21)27)17(20)24-15)10-7-9-3-2-5-22-13(9)11(19)8-10;1-25-7-5-13(24-25)16-15(23-18(26-2)17(20)22-16)11-8-10-4-3-6-21-14(10)12(19)9-11;1-24-6-4-12(23-24)15-14(22-17(25)16(19)21-15)10-7-9-3-2-5-20-13(9)11(18)8-10;1-9-4-6-24(23-9)16-14(21-17(25)15(19)22-16)11-7-10-3-2-5-20-13(10)12(18)8-11;1-24-6-4-13(23-24)17-16(21-9-14(19)22-17)11-7-10-3-2-5-20-15(10)12(18)8-11/h2-8H,1H3,(H2,20,24)(H2,21,27);3-9H,1-2H3,(H2,20,22);2-8H,1H3,(H2,19,21)(H,22,25);2-8H,1H3,(H2,19,22)(H,21,25);2-9H,1H3,(H2,19,22).

What are the key properties of 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine?

3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine has a molecular weight of 1772.52 g/mol, XLogP of 13.91, 12 rotatable bonds, 8 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide;3-amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-1H-pyrazin-2-one;3-amino-6-(8-chloroquinolin-6-yl)-5-(3-methylpyrazol-1-yl)-1H-pyrazin-2-one;5-(8-chloroquinolin-6-yl)-3-methoxy-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-fluoroquinolin-6-yl)-6-(1-methylpyrazol-3-yl)pyrazin-2-amine is sourced from PubChem (CID 159614276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).