1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone

C118H111Cl5N30O6 — CID 158177035

About 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone

1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone (PubChem CID 158177035) has the molecular formula C118H111Cl5N30O6 and a molecular weight of 2222.65 g/mol. Its IUPAC name is 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone.

Molecular Properties

• Compound Name: 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone
• PubChem CID: 158177035
• Molecular Formula: C118H111Cl5N30O6
• Molecular Weight: 2222.65 g/mol
• Exact Mass: 2218.77
• IUPAC Name: 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone
• SMILES: CC1CN(CC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)CCN1C.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CC1CCCCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCOCC1
• InChI: InChI=1S/C25H26ClN7O.C25H24ClN5O.C23H21ClN6O2.C23H21ClN6O.C22H19ClN6O/c1-15-13-33(9-8-32(15)2)14-20(34)24-25(27)30-22(16-6-4-3-5-7-16)23(29-24)17-10-18-12-28-31-21(18)19(26)11-17;26-19-13-17(12-18-14-28-31-21(18)19)23-22(16-9-5-2-6-10-16)30-25(27)24(29-23)20(32)11-15-7-3-1-4-8-15;24-17-11-15(10-16-12-26-29-19(16)17)21-20(14-4-2-1-3-5-14)28-23(25)22(27-21)18(31)13-30-6-8-32-9-7-30;24-17-11-15(10-16-12-26-29-19(16)17)21-20(14-6-2-1-3-7-14)28-23(25)22(27-21)18(31)13-30-8-4-5-9-30;23-16-10-14(9-15-11-25-28-18(15)16)20-19(13-5-2-1-3-6-13)27-22(24)21(26-20)17(30)12-29-7-4-8-29/h3-7,10-12,15H,8-9,13-14H2,1-2H3,(H2,27,30)(H,28,31);2,5-6,9-10,12-15H,1,3-4,7-8,11H2,(H2,27,30)(H,28,31);1-5,10-12H,6-9,13H2,(H2,25,28)(H,26,29);1-3,6-7,10-12H,4-5,8-9,13H2,(H2,25,28)(H,26,29);1-3,5-6,9-11H,4,7-8,12H2,(H2,24,27)(H,25,28)
• InChIKey: FYCVLNNUWMGTMC-UHFFFAOYSA-N
• XLogP: 21.27
• TPSA: 513.18 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 31
• Rotatable Bonds: 25
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2222.65
LogP ≤ 5	21.27
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone?

The IUPAC name of 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone (CID 158177035) is 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone.

What is the SMILES notation for 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone?

The canonical SMILES for 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone is CC1CN(CC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)CCN1C.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CC1CCCCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCCC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)CN1CCOCC1.

What is the InChIKey of 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone?

The InChIKey is FYCVLNNUWMGTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26ClN7O.C25H24ClN5O.C23H21ClN6O2.C23H21ClN6O.C22H19ClN6O/c1-15-13-33(9-8-32(15)2)14-20(34)24-25(27)30-22(16-6-4-3-5-7-16)23(29-24)17-10-18-12-28-31-21(18)19(26)11-17;26-19-13-17(12-18-14-28-31-21(18)19)23-22(16-9-5-2-6-10-16)30-25(27)24(29-23)20(32)11-15-7-3-1-4-8-15;24-17-11-15(10-16-12-26-29-19(16)17)21-20(14-4-2-1-3-5-14)28-23(25)22(27-21)18(31)13-30-6-8-32-9-7-30;24-17-11-15(10-16-12-26-29-19(16)17)21-20(14-6-2-1-3-7-14)28-23(25)22(27-21)18(31)13-30-8-4-5-9-30;23-16-10-14(9-15-11-25-28-18(15)16)20-19(13-5-2-1-3-6-13)27-22(24)21(26-20)17(30)12-29-7-4-8-29/h3-7,10-12,15H,8-9,13-14H2,1-2H3,(H2,27,30)(H,28,31);2,5-6,9-10,12-15H,1,3-4,7-8,11H2,(H2,27,30)(H,28,31);1-5,10-12H,6-9,13H2,(H2,25,28)(H,26,29);1-3,6-7,10-12H,4-5,8-9,13H2,(H2,25,28)(H,26,29);1-3,5-6,9-11H,4,7-8,12H2,(H2,24,27)(H,25,28).

What are the key properties of 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone?

1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone has a molecular weight of 2222.65 g/mol, XLogP of 21.27, 25 rotatable bonds, 10 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(azetidin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-cyclohexylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-(3,4-dimethylpiperazin-1-yl)ethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-morpholin-4-ylethanone;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-2-pyrrolidin-1-ylethanone is sourced from PubChem (CID 158177035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).