3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine

C85H74F10N28O6S2 — CID 159505660

About 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine

3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine (PubChem CID 159505660) has the molecular formula C85H74F10N28O6S2 and a molecular weight of 1837.83 g/mol. Its IUPAC name is 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine.

Molecular Properties

• Compound Name: 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine
• PubChem CID: 159505660
• Molecular Formula: C85H74F10N28O6S2
• Molecular Weight: 1837.83 g/mol
• Exact Mass: 1836.56
• IUPAC Name: 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine
• SMILES: CNS(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.CS(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.FC(F)c1cn2c(-c3nccc(C4=CCCC4)n3)cnc2cn1.OCc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1.Oc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1
• InChI: InChI=1S/C18H13F2N5O.C17H19F2N7O2S.C17H18F2N6O2S.C17H11F2N5O.C16H13F2N5/c19-17(20)14-9-25-15(7-23-16(25)8-22-14)18-21-5-4-13(24-18)12-3-1-2-11(6-12)10-26;1-20-29(27,28)11-3-2-6-25(9-11)14-4-5-21-17(24-14)13-7-23-15-8-22-12(16(18)19)10-26(13)15;1-28(26,27)11-3-2-6-24(9-11)14-4-5-20-17(23-14)13-7-22-15-8-21-12(16(18)19)10-25(13)15;18-16(19)13-9-24-14(7-22-15(24)8-21-13)17-20-5-4-12(23-17)10-2-1-3-11(25)6-10;17-15(18)12-9-23-13(7-21-14(23)8-20-12)16-19-6-5-11(22-16)10-3-1-2-4-10/h1-9,17,26H,10H2;4-5,7-8,10-11,16,20H,2-3,6,9H2,1H3;4-5,7-8,10-11,16H,2-3,6,9H2,1H3;1-9,16,25H;3,5-9,15H,1-2,4H2
• InChIKey: LZYKGYQNWDOCGD-UHFFFAOYSA-N
• XLogP: 14.25
• TPSA: 407.10 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 33
• Rotatable Bonds: 19
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1837.83
LogP ≤ 5	14.25
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The IUPAC name of 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine (CID 159505660) is 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine.

What is the SMILES notation for 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The canonical SMILES for 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine is CNS(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.CS(=O)(=O)C1CCCN(c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)C1.FC(F)c1cn2c(-c3nccc(C4=CCCC4)n3)cnc2cn1.OCc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1.Oc1cccc(-c2ccnc(-c3cnc4cnc(C(F)F)cn34)n2)c1.

What is the InChIKey of 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

The InChIKey is LZYKGYQNWDOCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2N5O.C17H19F2N7O2S.C17H18F2N6O2S.C17H11F2N5O.C16H13F2N5/c19-17(20)14-9-25-15(7-23-16(25)8-22-14)18-21-5-4-13(24-18)12-3-1-2-11(6-12)10-26;1-20-29(27,28)11-3-2-6-25(9-11)14-4-5-21-17(24-14)13-7-23-15-8-22-12(16(18)19)10-26(13)15;1-28(26,27)11-3-2-6-24(9-11)14-4-5-20-17(23-14)13-7-22-15-8-21-12(16(18)19)10-25(13)15;18-16(19)13-9-24-14(7-22-15(24)8-21-13)17-20-5-4-12(23-17)10-2-1-3-11(25)6-10;17-15(18)12-9-23-13(7-21-14(23)8-20-12)16-19-6-5-11(22-16)10-3-1-2-4-10/h1-9,17,26H,10H2;4-5,7-8,10-11,16,20H,2-3,6,9H2,1H3;4-5,7-8,10-11,16H,2-3,6,9H2,1H3;1-9,16,25H;3,5-9,15H,1-2,4H2.

What are the key properties of 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine?

3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine has a molecular weight of 1837.83 g/mol, XLogP of 14.25, 19 rotatable bonds, 3 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(cyclopenten-1-yl)pyrimidin-2-yl]-6-(difluoromethyl)imidazo[1,2-a]pyrazine;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-sulfonamide;3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenol;[3-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]phenyl]methanol;6-(difluoromethyl)-3-[4-(3-methylsulfonylpiperidin-1-yl)pyrimidin-2-yl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 159505660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).