1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine

C97H101F10N33O7S3 — CID 159059138

About 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine

1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine (PubChem CID 159059138) has the molecular formula C97H101F10N33O7S3 and a molecular weight of 2127.28 g/mol. Its IUPAC name is 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine.

Molecular Properties

• Compound Name: 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine
• PubChem CID: 159059138
• Molecular Formula: C97H101F10N33O7S3
• Molecular Weight: 2127.28 g/mol
• Exact Mass: 2125.76
• IUPAC Name: 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine
• SMILES: CN(C)S(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.CN(C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1)S(C)(=O)=O.CN1CCN(Cc2cccc(-c3ccnc(-c4cnc5cnc(C(F)F)cn45)n3)c2)CC1.CS(=O)(=O)CC1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.NCC(=O)Cc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1
• InChI: InChI=1S/C23H23F2N7.C20H16F2N6O.2C18H21F2N7O2S.C18H20F2N6O2S/c1-30-7-9-31(10-8-30)14-16-3-2-4-17(11-16)18-5-6-26-23(29-18)20-12-28-21-13-27-19(22(24)25)15-32(20)21;21-19(22)16-11-28-17(9-26-18(28)10-25-16)20-24-5-4-15(27-20)13-3-1-2-12(6-13)7-14(29)8-23;1-25(30(2,28)29)12-4-3-7-26(10-12)15-5-6-21-18(24-15)14-8-23-16-9-22-13(17(19)20)11-27(14)16;1-25(2)30(28,29)12-4-3-7-26(10-12)15-5-6-21-18(24-15)14-8-23-16-9-22-13(17(19)20)11-27(14)16;1-29(27,28)11-12-3-2-6-25(9-12)15-4-5-21-18(24-15)14-7-23-16-8-22-13(17(19)20)10-26(14)16/h2-6,11-13,15,22H,7-10,14H2,1H3;1-6,9-11,19H,7-8,23H2;2*5-6,8-9,11-12,17H,3-4,7,10H2,1-2H3;4-5,7-8,10,12,17H,2-3,6,9,11H2,1H3
• InChIKey: JYFVNVSPFWHSHS-UHFFFAOYSA-N
• XLogP: 12.75
• TPSA: 448.04 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 38
• Rotatable Bonds: 26
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2127.28
LogP ≤ 5	12.75
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The IUPAC name of 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine (CID 159059138) is 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine.

What is the SMILES notation for 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The canonical SMILES for 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine is CN(C)S(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.CN(C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1)S(C)(=O)=O.CN1CCN(Cc2cccc(-c3ccnc(-c4cnc5cnc(C(F)F)cn45)n3)c2)CC1.CS(=O)(=O)CC1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.NCC(=O)Cc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1.

What is the InChIKey of 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The InChIKey is JYFVNVSPFWHSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23F2N7.C20H16F2N6O.2C18H21F2N7O2S.C18H20F2N6O2S/c1-30-7-9-31(10-8-30)14-16-3-2-4-17(11-16)18-5-6-26-23(29-18)20-12-28-21-13-27-19(22(24)25)15-32(20)21;21-19(22)16-11-28-17(9-26-18(28)10-25-16)20-24-5-4-15(27-20)13-3-1-2-12(6-13)7-14(29)8-23;1-25(30(2,28)29)12-4-3-7-26(10-12)15-5-6-21-18(24-15)14-8-23-16-9-22-13(17(19)20)11-27(14)16;1-25(2)30(28,29)12-4-3-7-26(10-12)15-5-6-21-18(24-15)14-8-23-16-9-22-13(17(19)20)11-27(14)16;1-29(27,28)11-12-3-2-6-25(9-12)15-4-5-21-18(24-15)14-7-23-16-8-22-13(17(19)20)10-26(14)16/h2-6,11-13,15,22H,7-10,14H2,1H3;1-6,9-11,19H,7-8,23H2;2*5-6,8-9,11-12,17H,3-4,7,10H2,1-2H3;4-5,7-8,10,12,17H,2-3,6,9,11H2,1H3.

What are the key properties of 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine has a molecular weight of 2127.28 g/mol, XLogP of 12.75, 26 rotatable bonds, 1 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 1-amino-3-[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]propan-2-one;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N,N-dimethylpiperidine-3-sulfonamide;N-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]-N-methylmethanesulfonamide;6-(difluoromethyl)-3-[4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine;6-(difluoromethyl)-3-[4-[3-(methylsulfonylmethyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 159059138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).