5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine

C81H97N25O4 — CID 167624508

About 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine

5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine (PubChem CID 167624508) has the molecular formula C81H97N25O4 and a molecular weight of 1484.84 g/mol. Its IUPAC name is 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine.

Molecular Properties

• Compound Name: 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine
• PubChem CID: 167624508
• Molecular Formula: C81H97N25O4
• Molecular Weight: 1484.84 g/mol
• Exact Mass: 1483.82
• IUPAC Name: 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine
• SMILES: COc1cnn(-c2nc(-c3cc(C)c4c(c3)CN(C)CC4)cnc2N)c1.Cc1cc(-c2cnc(N)c(Oc3cn[nH]c3C)n2)cc2c1CCN(C)C2.Cc1cc(-c2cnc(N)c(Oc3cnn(C)c3)n2)cc2c1CCN(C)C2.Cc1cc(-c2cnc(N)c(Oc3cnn(C4CCN(C)CC4)c3)n2)cc2c1CCN(C)C2
• InChI: InChI=1S/C24H31N7O.3C19H22N6O/c1-16-10-17(11-18-14-30(3)9-6-21(16)18)22-13-26-23(25)24(28-22)32-20-12-27-31(15-20)19-4-7-29(2)8-5-19;1-12-6-13(7-14-10-24(2)5-4-16(12)14)17-9-21-18(20)19(23-17)25-11-15(26-3)8-22-25;1-12-6-13(7-14-10-24(2)5-4-16(12)14)17-9-21-18(20)19(23-17)26-15-8-22-25(3)11-15;1-11-6-13(7-14-10-25(3)5-4-15(11)14)16-8-21-18(20)19(23-16)26-17-9-22-24-12(17)2/h10-13,15,19H,4-9,14H2,1-3H3,(H2,25,26);2*6-9,11H,4-5,10H2,1-3H3,(H2,20,21);6-9H,4-5,10H2,1-3H3,(H2,20,21)(H,22,24)
• InChIKey: MXEYSOKXPJWEIT-UHFFFAOYSA-N
• XLogP: 10.89
• TPSA: 342.46 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 28
• Rotatable Bonds: 13
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1484.84
LogP ≤ 5	10.89
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine?

The IUPAC name of 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine (CID 167624508) is 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine.

What is the SMILES notation for 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine?

The canonical SMILES for 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine is COc1cnn(-c2nc(-c3cc(C)c4c(c3)CN(C)CC4)cnc2N)c1.Cc1cc(-c2cnc(N)c(Oc3cn[nH]c3C)n2)cc2c1CCN(C)C2.Cc1cc(-c2cnc(N)c(Oc3cnn(C)c3)n2)cc2c1CCN(C)C2.Cc1cc(-c2cnc(N)c(Oc3cnn(C4CCN(C)CC4)c3)n2)cc2c1CCN(C)C2.

What is the InChIKey of 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine?

The InChIKey is MXEYSOKXPJWEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N7O.3C19H22N6O/c1-16-10-17(11-18-14-30(3)9-6-21(16)18)22-13-26-23(25)24(28-22)32-20-12-27-31(15-20)19-4-7-29(2)8-5-19;1-12-6-13(7-14-10-24(2)5-4-16(12)14)17-9-21-18(20)19(23-17)25-11-15(26-3)8-22-25;1-12-6-13(7-14-10-24(2)5-4-16(12)14)17-9-21-18(20)19(23-17)26-15-8-22-25(3)11-15;1-11-6-13(7-14-10-25(3)5-4-15(11)14)16-8-21-18(20)19(23-16)26-17-9-22-24-12(17)2/h10-13,15,19H,4-9,14H2,1-3H3,(H2,25,26);2*6-9,11H,4-5,10H2,1-3H3,(H2,20,21);6-9H,4-5,10H2,1-3H3,(H2,20,21)(H,22,24).

What are the key properties of 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine?

5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine has a molecular weight of 1484.84 g/mol, XLogP of 10.89, 13 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-methoxypyrazol-1-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-methylpyrazol-4-yl)oxypyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[(5-methyl-1H-pyrazol-4-yl)oxy]pyrazin-2-amine is sourced from PubChem (CID 167624508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).