2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate

C74H80Br5N25O6 — CID 160977145

About 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate

2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate (PubChem CID 160977145) has the molecular formula C74H80Br5N25O6 and a molecular weight of 1815.14 g/mol. Its IUPAC name is 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate.

Molecular Properties

• Compound Name: 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate
• PubChem CID: 160977145
• Molecular Formula: C74H80Br5N25O6
• Molecular Weight: 1815.14 g/mol
• Exact Mass: 1809.26
• IUPAC Name: 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate
• SMILES: Brc1cnc(Br)cn1.C=Cc1cnc(Br)cn1.CCN(CCc1cnc(Br)cn1)C(=O)c1ccccc1-n1nccn1.CCN(CCc1cnc(C(=O)OC)cn1)C(=O)c1ccccc1-n1nccn1.CCN(CCc1cnc(C(C)(C)O)cn1)C(=O)c1ccccc1-n1nccn1.CCNCCc1cnc(Br)cn1
• InChI: InChI=1S/C20H24N6O2.C19H20N6O3.C17H17BrN6O.C8H12BrN3.C6H5BrN2.C4H2Br2N2/c1-4-25(12-9-15-13-22-18(14-21-15)20(2,3)28)19(27)16-7-5-6-8-17(16)26-23-10-11-24-26;1-3-24(11-8-14-12-21-16(13-20-14)19(27)28-2)18(26)15-6-4-5-7-17(15)25-22-9-10-23-25;1-2-23(10-7-13-11-20-16(18)12-19-13)17(25)14-5-3-4-6-15(14)24-21-8-9-22-24;1-2-10-4-3-7-5-12-8(9)6-11-7;1-2-5-3-9-6(7)4-8-5;5-3-1-7-4(6)2-8-3/h5-8,10-11,13-14,28H,4,9,12H2,1-3H3;4-7,9-10,12-13H,3,8,11H2,1-2H3;3-6,8-9,11-12H,2,7,10H2,1H3;5-6,10H,2-4H2,1H3;2-4H,1H2;1-2H
• InChIKey: SZADJFFXSKWUOC-UHFFFAOYSA-N
• XLogP: 11.34
• TPSA: 366.30 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 28
• Rotatable Bonds: 25
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1815.14
LogP ≤ 5	11.34
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate?

The IUPAC name of 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate (CID 160977145) is 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate.

What is the SMILES notation for 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate?

The canonical SMILES for 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate is Brc1cnc(Br)cn1.C=Cc1cnc(Br)cn1.CCN(CCc1cnc(Br)cn1)C(=O)c1ccccc1-n1nccn1.CCN(CCc1cnc(C(=O)OC)cn1)C(=O)c1ccccc1-n1nccn1.CCN(CCc1cnc(C(C)(C)O)cn1)C(=O)c1ccccc1-n1nccn1.CCNCCc1cnc(Br)cn1.

What is the InChIKey of 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate?

The InChIKey is SZADJFFXSKWUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O2.C19H20N6O3.C17H17BrN6O.C8H12BrN3.C6H5BrN2.C4H2Br2N2/c1-4-25(12-9-15-13-22-18(14-21-15)20(2,3)28)19(27)16-7-5-6-8-17(16)26-23-10-11-24-26;1-3-24(11-8-14-12-21-16(13-20-14)19(27)28-2)18(26)15-6-4-5-7-17(15)25-22-9-10-23-25;1-2-23(10-7-13-11-20-16(18)12-19-13)17(25)14-5-3-4-6-15(14)24-21-8-9-22-24;1-2-10-4-3-7-5-12-8(9)6-11-7;1-2-5-3-9-6(7)4-8-5;5-3-1-7-4(6)2-8-3/h5-8,10-11,13-14,28H,4,9,12H2,1-3H3;4-7,9-10,12-13H,3,8,11H2,1-2H3;3-6,8-9,11-12H,2,7,10H2,1H3;5-6,10H,2-4H2,1H3;2-4H,1H2;1-2H.

What are the key properties of 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate?

2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate has a molecular weight of 1815.14 g/mol, XLogP of 11.34, 25 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-5-ethenylpyrazine;2-(5-bromopyrazin-2-yl)-N-ethylethanamine;N-[2-(5-bromopyrazin-2-yl)ethyl]-N-ethyl-2-(triazol-2-yl)benzamide;2,5-dibromopyrazine;N-ethyl-N-[2-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]ethyl]-2-(triazol-2-yl)benzamide;methyl 5-[2-[ethyl-[2-(triazol-2-yl)benzoyl]amino]ethyl]pyrazine-2-carboxylate is sourced from PubChem (CID 160977145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).