[(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine

C117H128BrN21O3Pt — CID 159621598

About [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine

[(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine (PubChem CID 159621598) has the molecular formula C117H128BrN21O3Pt and a molecular weight of 2151.44 g/mol. Its IUPAC name is [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine.

Molecular Properties

• Compound Name: [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine
• PubChem CID: 159621598
• Molecular Formula: C117H128BrN21O3Pt
• Molecular Weight: 2151.44 g/mol
• Exact Mass: 2148.93
• IUPAC Name: [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine
• SMILES: NC1=C(C(=NC2CCCCO2)c2cccc(-c3cccc(-c4cccc(-c5c6c(nn5C5CCCCO5)CCCC6)n4)c3)n2)CCCC1.NC1=C(C(=NC2CCCCO2)c2cccc(Br)n2)CCCC1.[H]/N=C(\C1=C(N)CCCC1)c1cccc(-c2cccc(-c3cccc(-c4n[nH]c5c4CCCC5)n3)c2)n1.[H]/N=C1/CCCC/C1=C(/[NH-])c1cccc(-c2cccc(-c3cccc(/C([NH-])=C4\CCCC\C4=N/[H])n3)c2)n1.[Pt+2]
• InChI: InChI=1S/C40H46N6O2.2C30H30N6.C17H22BrN3O.Pt/c41-31-16-3-1-14-29(31)39(44-37-22-5-7-24-47-37)35-20-10-18-32(42-35)27-12-9-13-28(26-27)33-19-11-21-36(43-33)40-30-15-2-4-17-34(30)45-46(40)38-23-6-8-25-48-38;31-23-12-3-1-10-21(23)29(32)27-16-6-14-24(33-27)19-8-5-9-20(18-19)25-15-7-17-28(34-25)30-22-11-2-4-13-26(22)35-36-30;31-23-12-3-1-10-21(23)29(33)27-16-6-14-25(35-27)19-8-5-9-20(18-19)26-15-7-17-28(36-26)30(34)22-11-2-4-13-24(22)32;18-15-9-5-8-14(20-15)17(12-6-1-2-7-13(12)19)21-16-10-3-4-11-22-16;/h9-13,18-21,26,37-38H,1-8,14-17,22-25,41H2;5-9,14-18,32H,1-4,10-13,31H2,(H,35,36);5-9,14-18,31-34H,1-4,10-13H2;5,8-9,16H,1-4,6-7,10-11,19H2;/q;;-2;;+2/b;32-29+;29-21-,30-22-,31-23-,32-24+
• InChIKey: RZACQEHBOUFLRZ-GACUZKTJSA-N
• XLogP: 27.06
• TPSA: 386.35 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 21
• Rotatable Bonds: 19
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2151.44
LogP ≤ 5	27.06
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine?

The IUPAC name of [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine (CID 159621598) is [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine.

What is the SMILES notation for [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine?

The canonical SMILES for [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine is NC1=C(C(=NC2CCCCO2)c2cccc(-c3cccc(-c4cccc(-c5c6c(nn5C5CCCCO5)CCCC6)n4)c3)n2)CCCC1.NC1=C(C(=NC2CCCCO2)c2cccc(Br)n2)CCCC1.[H]/N=C(\C1=C(N)CCCC1)c1cccc(-c2cccc(-c3cccc(-c4n[nH]c5c4CCCC5)n3)c2)n1.[H]/N=C1/CCCC/C1=C(/[NH-])c1cccc(-c2cccc(-c3cccc(/C([NH-])=C4\CCCC\C4=N/[H])n3)c2)n1.[Pt+2].

What is the InChIKey of [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine?

The InChIKey is RZACQEHBOUFLRZ-GACUZKTJSA-N. The full InChI is InChI=1S/C40H46N6O2.2C30H30N6.C17H22BrN3O.Pt/c41-31-16-3-1-14-29(31)39(44-37-22-5-7-24-47-37)35-20-10-18-32(42-35)27-12-9-13-28(26-27)33-19-11-21-36(43-33)40-30-15-2-4-17-34(30)45-46(40)38-23-6-8-25-48-38;31-23-12-3-1-10-21(23)29(32)27-16-6-14-24(33-27)19-8-5-9-20(18-19)25-15-7-17-28(34-25)30-22-11-2-4-13-26(22)35-36-30;31-23-12-3-1-10-21(23)29(33)27-16-6-14-25(35-27)19-8-5-9-20(18-19)26-15-7-17-28(36-26)30(34)22-11-2-4-13-24(22)32;18-15-9-5-8-14(20-15)17(12-6-1-2-7-13(12)19)21-16-10-3-4-11-22-16;/h9-13,18-21,26,37-38H,1-8,14-17,22-25,41H2;5-9,14-18,32H,1-4,10-13,31H2,(H,35,36);5-9,14-18,31-34H,1-4,10-13H2;5,8-9,16H,1-4,6-7,10-11,19H2;/q;;-2;;+2/b;32-29+;29-21-,30-22-,31-23-,32-24+;;.

What are the key properties of [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine?

[(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine has a molecular weight of 2151.44 g/mol, XLogP of 27.06, 19 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for [(Z)-[6-[3-[6-[(Z)-azanidyl-(2-iminocyclohexylidene)methyl]-2-pyridinyl]phenyl]-2-pyridinyl]-(2-iminocyclohexylidene)methyl]azanide;2-[C-(6-bromo-2-pyridinyl)-N-(oxan-2-yl)carbonimidoyl]cyclohexen-1-amine;2-[N-(oxan-2-yl)-C-[6-[3-[6-[2-(oxan-2-yl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]phenyl]-2-pyridinyl]carbonimidoyl]cyclohexen-1-amine;platinum(2+);2-[6-[3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)-2-pyridinyl]phenyl]pyridine-2-carboximidoyl]cyclohexen-1-amine is sourced from PubChem (CID 159621598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).