4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol

C88H80Cl6N30O6 — CID 158140909

About 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol

4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol (PubChem CID 158140909) has the molecular formula C88H80Cl6N30O6 and a molecular weight of 1866.53 g/mol. Its IUPAC name is 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol.

Molecular Properties

• Compound Name: 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol
• PubChem CID: 158140909
• Molecular Formula: C88H80Cl6N30O6
• Molecular Weight: 1866.53 g/mol
• Exact Mass: 1862.50
• IUPAC Name: 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol
• SMILES: Cc1cc(C)n(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)n1.Cc1ccn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)n1.Cc1cn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)nc1C.Cc1cnn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1.Cc1cnn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1C.Cc1nn(C)cc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1
• InChI: InChI=1S/4C15H14ClN5O.2C14H12ClN5O/c1-8-10(7-21(2)20-8)15-14(18-6-13(17)19-15)9-3-4-12(22)11(16)5-9;1-8-7-21(20-9(8)2)15-14(18-6-13(17)19-15)10-3-4-12(22)11(16)5-10;1-8-6-19-21(9(8)2)15-14(18-7-13(17)20-15)10-3-4-12(22)11(16)5-10;1-8-5-9(2)21(20-8)15-14(18-7-13(17)19-15)10-3-4-12(22)11(16)6-10;1-8-5-18-20(7-8)14-13(17-6-12(16)19-14)9-2-3-11(21)10(15)4-9;1-8-4-5-20(19-8)14-13(17-7-12(16)18-14)9-2-3-11(21)10(15)6-9/h2*3-7,22H,1-2H3,(H2,17,19);3-7,22H,1-2H3,(H2,17,20);3-7,22H,1-2H3,(H2,17,19);2-7,21H,1H3,(H2,16,19);2-7,21H,1H3,(H2,16,18)
• InChIKey: FTXRMXPEOWXXBC-UHFFFAOYSA-N
• XLogP: 16.61
• TPSA: 539.10 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 36
• Rotatable Bonds: 12
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1866.53
LogP ≤ 5	16.61
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

What is the IUPAC name of 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol?

The IUPAC name of 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol (CID 158140909) is 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol.

What is the SMILES notation for 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol?

The canonical SMILES for 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol is Cc1cc(C)n(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)n1.Cc1ccn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)n1.Cc1cn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)nc1C.Cc1cnn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1.Cc1cnn(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1C.Cc1nn(C)cc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.

What is the InChIKey of 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol?

The InChIKey is FTXRMXPEOWXXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/4C15H14ClN5O.2C14H12ClN5O/c1-8-10(7-21(2)20-8)15-14(18-6-13(17)19-15)9-3-4-12(22)11(16)5-9;1-8-7-21(20-9(8)2)15-14(18-6-13(17)19-15)10-3-4-12(22)11(16)5-10;1-8-6-19-21(9(8)2)15-14(18-7-13(17)20-15)10-3-4-12(22)11(16)5-10;1-8-5-9(2)21(20-8)15-14(18-7-13(17)19-15)10-3-4-12(22)11(16)6-10;1-8-5-18-20(7-8)14-13(17-6-12(16)19-14)9-2-3-11(21)10(15)4-9;1-8-4-5-20(19-8)14-13(17-7-12(16)18-14)9-2-3-11(21)10(15)6-9/h2*3-7,22H,1-2H3,(H2,17,19);3-7,22H,1-2H3,(H2,17,20);3-7,22H,1-2H3,(H2,17,19);2-7,21H,1H3,(H2,16,19);2-7,21H,1H3,(H2,16,18).

What are the key properties of 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol?

4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol has a molecular weight of 1866.53 g/mol, XLogP of 16.61, 12 rotatable bonds, 12 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[5-amino-3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,4-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylpyrazol-1-yl)pyrazin-2-yl]-2-chlorophenol is sourced from PubChem (CID 158140909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).