[2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper

C61H75Br3Cl3Cu2N13O8 — CID 157117423

About [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper

[2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper (PubChem CID 157117423) has the molecular formula C61H75Br3Cl3Cu2N13O8 and a molecular weight of 1591.52 g/mol. Its IUPAC name is [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper.

Molecular Properties

• Compound Name: [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper
• PubChem CID: 157117423
• Molecular Formula: C61H75Br3Cl3Cu2N13O8
• Molecular Weight: 1591.52 g/mol
• Exact Mass: 1585.11
• IUPAC Name: [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper
• SMILES: COc1cc(CO)c(-c2cn3cc(Br)c(N4CCCC4)cc3n2)cc1Cl.COc1cc(CO)c(-c2cn3cc(NCCN)c(N4CCCC4)cc3n2)cc1Cl.COc1cc(CO)c(Cl)cc1C(=O)CBr.NCCN.Nc1cc(N2CCCC2)c(Br)cn1.O=[Cu].[Cu]
• InChI: InChI=1S/C21H26ClN5O2.C19H19BrClN3O2.C10H10BrClO3.C9H12BrN3.C2H8N2.2Cu.O/c1-29-20-8-14(13-28)15(9-16(20)22)17-11-27-12-18(24-5-4-23)19(10-21(27)25-17)26-6-2-3-7-26;1-26-18-6-12(11-25)13(7-15(18)21)16-10-24-9-14(20)17(8-19(24)22-16)23-4-2-3-5-23;1-15-10-2-6(5-13)8(12)3-7(10)9(14)4-11;10-7-6-12-9(11)5-8(7)13-3-1-2-4-13;3-1-2-4;;;/h8-12,24,28H,2-7,13,23H2,1H3;6-10,25H,2-5,11H2,1H3;2-3,13H,4-5H2,1H3;5-6H,1-4H2,(H2,11,12);1-4H2
• InChIKey: GDIGOBSBQDDQLN-UHFFFAOYSA-N
• XLogP: 10.87
• TPSA: 295.84 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 21
• Rotatable Bonds: 17
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1591.52
LogP ≤ 5	10.87
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper?

The IUPAC name of [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper (CID 157117423) is [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper.

What is the SMILES notation for [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper?

The canonical SMILES for [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper is COc1cc(CO)c(-c2cn3cc(Br)c(N4CCCC4)cc3n2)cc1Cl.COc1cc(CO)c(-c2cn3cc(NCCN)c(N4CCCC4)cc3n2)cc1Cl.COc1cc(CO)c(Cl)cc1C(=O)CBr.NCCN.Nc1cc(N2CCCC2)c(Br)cn1.O=[Cu].[Cu].

What is the InChIKey of [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper?

The InChIKey is GDIGOBSBQDDQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26ClN5O2.C19H19BrClN3O2.C10H10BrClO3.C9H12BrN3.C2H8N2.2Cu.O/c1-29-20-8-14(13-28)15(9-16(20)22)17-11-27-12-18(24-5-4-23)19(10-21(27)25-17)26-6-2-3-7-26;1-26-18-6-12(11-25)13(7-15(18)21)16-10-24-9-14(20)17(8-19(24)22-16)23-4-2-3-5-23;1-15-10-2-6(5-13)8(12)3-7(10)9(14)4-11;10-7-6-12-9(11)5-8(7)13-3-1-2-4-13;3-1-2-4;;;/h8-12,24,28H,2-7,13,23H2,1H3;6-10,25H,2-5,11H2,1H3;2-3,13H,4-5H2,1H3;5-6H,1-4H2,(H2,11,12);1-4H2;;;.

What are the key properties of [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper?

[2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper has a molecular weight of 1591.52 g/mol, XLogP of 10.87, 17 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[6-(2-aminoethylamino)-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-methoxyphenyl]ethanone;[2-(6-bromo-7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)-4-chloro-5-methoxyphenyl]methanol;5-bromo-4-pyrrolidin-1-ylpyridin-2-amine;copper;ethane-1,2-diamine;oxocopper is sourced from PubChem (CID 157117423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).