2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol

C69H88N20O4 — CID 158837760

About 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol

2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol (PubChem CID 158837760) has the molecular formula C69H88N20O4 and a molecular weight of 1261.60 g/mol. Its IUPAC name is 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol.

Molecular Properties

• Compound Name: 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol
• PubChem CID: 158837760
• Molecular Formula: C69H88N20O4
• Molecular Weight: 1261.60 g/mol
• Exact Mass: 1260.73
• IUPAC Name: 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol
• SMILES: CC1(C)CC(C(N)c2cnc(-c3ccc(-c4cn[nH]c4)cc3O)cn2)CC(C)(C)N1.CN(c1cnc(-c2ccc(-c3ncnc(=O)[nH]3)cc2O)cn1)C1CC(C)(C)NC(C)(C)C1.CN(c1cnc(-c2ccc(-c3ncncn3)cc2O)cn1)C1CC(C)(C)NC(C)(C)C1
• InChI: InChI=1S/C23H29N7O2.C23H29N7O.C23H30N6O/c1-22(2)9-15(10-23(3,4)29-22)30(5)19-12-24-17(11-25-19)16-7-6-14(8-18(16)31)20-26-13-27-21(32)28-20;1-22(2)9-16(10-23(3,4)29-22)30(5)20-12-25-18(11-26-20)17-7-6-15(8-19(17)31)21-27-13-24-14-28-21;1-22(2)8-15(9-23(3,4)29-22)21(24)19-13-25-18(12-26-19)17-6-5-14(7-20(17)30)16-10-27-28-11-16/h6-8,11-13,15,29,31H,9-10H2,1-5H3,(H,26,27,28,32);6-8,11-14,16,29,31H,9-10H2,1-5H3;5-7,10-13,15,21,29-30H,8-9,24H2,1-4H3,(H,27,28)
• InChIKey: IXVVCEYWTNDZAW-UHFFFAOYSA-N
• XLogP: 9.98
• TPSA: 332.61 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 22
• Rotatable Bonds: 12
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1261.60
LogP ≤ 5	9.98
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol?

The IUPAC name of 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol (CID 158837760) is 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol.

What is the SMILES notation for 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol?

The canonical SMILES for 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol is CC1(C)CC(C(N)c2cnc(-c3ccc(-c4cn[nH]c4)cc3O)cn2)CC(C)(C)N1.CN(c1cnc(-c2ccc(-c3ncnc(=O)[nH]3)cc2O)cn1)C1CC(C)(C)NC(C)(C)C1.CN(c1cnc(-c2ccc(-c3ncncn3)cc2O)cn1)C1CC(C)(C)NC(C)(C)C1.

What is the InChIKey of 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol?

The InChIKey is IXVVCEYWTNDZAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N7O2.C23H29N7O.C23H30N6O/c1-22(2)9-15(10-23(3,4)29-22)30(5)19-12-24-17(11-25-19)16-7-6-14(8-18(16)31)20-26-13-27-21(32)28-20;1-22(2)9-16(10-23(3,4)29-22)30(5)20-12-25-18(11-26-20)17-7-6-15(8-19(17)31)21-27-13-24-14-28-21;1-22(2)8-15(9-23(3,4)29-22)21(24)19-13-25-18(12-26-19)17-6-5-14(7-20(17)30)16-10-27-28-11-16/h6-8,11-13,15,29,31H,9-10H2,1-5H3,(H,26,27,28,32);6-8,11-14,16,29,31H,9-10H2,1-5H3;5-7,10-13,15,21,29-30H,8-9,24H2,1-4H3,(H,27,28).

What are the key properties of 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol?

2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol has a molecular weight of 1261.60 g/mol, XLogP of 9.98, 12 rotatable bonds, 9 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-[amino-(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyrazin-2-yl]-5-(1H-pyrazol-4-yl)phenol;6-[3-hydroxy-4-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]phenyl]-1H-1,3,5-triazin-2-one;2-[5-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyrazin-2-yl]-5-(1,3,5-triazin-2-yl)phenol is sourced from PubChem (CID 158837760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).