N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide

C40H37Cl3F6N12O2 — CID 159066483

About N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide

N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide (PubChem CID 159066483) has the molecular formula C40H37Cl3F6N12O2 and a molecular weight of 938.16 g/mol. Its IUPAC name is N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide.

Molecular Properties

• Compound Name: N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide
• PubChem CID: 159066483
• Molecular Formula: C40H37Cl3F6N12O2
• Molecular Weight: 938.16 g/mol
• Exact Mass: 936.21
• IUPAC Name: N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide
• SMILES: Cc1cnc(-c2cc(Cl)ncc2Cl)c(C)c1.Cc1cnc(-c2cc(N3CCn4cc(NC(=O)C(F)(F)F)nc4C3)ncc2Cl)c(C)c1.O=C(Nc1cn2c(n1)CNCC2)C(F)(F)F
• InChI: InChI=1S/C20H18ClF3N6O.C12H10Cl2N2.C8H9F3N4O/c1-11-5-12(2)18(26-7-11)13-6-16(25-8-14(13)21)30-4-3-29-9-15(27-17(29)10-30)28-19(31)20(22,23)24;1-7-3-8(2)12(16-5-7)9-4-11(14)15-6-10(9)13;9-8(10,11)7(16)14-5-4-15-2-1-12-3-6(15)13-5/h5-9H,3-4,10H2,1-2H3,(H,28,31);3-6H,1-2H3;4,12H,1-3H2,(H,14,16)
• InChIKey: JZCTUONWBDLLLT-UHFFFAOYSA-N
• XLogP: 8.69
• TPSA: 160.67 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 5
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	938.16
LogP ≤ 5	8.69
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide?

The IUPAC name of N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide (CID 159066483) is N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide.

What is the SMILES notation for N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide?

The canonical SMILES for N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide is Cc1cnc(-c2cc(Cl)ncc2Cl)c(C)c1.Cc1cnc(-c2cc(N3CCn4cc(NC(=O)C(F)(F)F)nc4C3)ncc2Cl)c(C)c1.O=C(Nc1cn2c(n1)CNCC2)C(F)(F)F.

What is the InChIKey of N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide?

The InChIKey is JZCTUONWBDLLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClF3N6O.C12H10Cl2N2.C8H9F3N4O/c1-11-5-12(2)18(26-7-11)13-6-16(25-8-14(13)21)30-4-3-29-9-15(27-17(29)10-30)28-19(31)20(22,23)24;1-7-3-8(2)12(16-5-7)9-4-11(14)15-6-10(9)13;9-8(10,11)7(16)14-5-4-15-2-1-12-3-6(15)13-5/h5-9H,3-4,10H2,1-2H3,(H,28,31);3-6H,1-2H3;4,12H,1-3H2,(H,14,16).

What are the key properties of N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide?

N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide has a molecular weight of 938.16 g/mol, XLogP of 8.69, 5 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[7-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-2,2,2-trifluoroacetamide;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine;2,2,2-trifluoro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)acetamide is sourced from PubChem (CID 159066483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).