N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine

C119H112N6 — CID 162140001

About N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine

N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine (PubChem CID 162140001) has the molecular formula C119H112N6 and a molecular weight of 1626.25 g/mol. Its IUPAC name is N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine.

Molecular Properties

• Compound Name: N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine
• PubChem CID: 162140001
• Molecular Formula: C119H112N6
• Molecular Weight: 1626.25 g/mol
• Exact Mass: 1624.89
• IUPAC Name: N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine
• SMILES: C/C(=N\c1c(C)cc(-c2c(C)cc(C)cc2C)cc1C)c1cc(C)cc(/C(C)=N/c2c(C)cc(-c3c(C)cc(C)cc3C)cc2C)n1.Cc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(C)cc3)c2-c2cc(C)c(/N=C/c3cccc(/C=N/c4c(C)cc(-c5c(-c6ccc(C)cc6)cc(-c6ccccc6)cc5-c5ccc(C)cc5)cc4C)n3)c(C)c2)cc1
• InChI: InChI=1S/C75H63N3.C44H49N3/c1-48-22-30-58(31-23-48)68-42-62(56-16-11-9-12-17-56)43-69(59-32-24-49(2)25-33-59)72(68)64-38-52(5)74(53(6)39-64)76-46-66-20-15-21-67(78-66)47-77-75-54(7)40-65(41-55(75)8)73-70(60-34-26-50(3)27-35-60)44-63(57-18-13-10-14-19-57)45-71(73)61-36-28-51(4)29-37-61;1-24-14-27(4)41(28(5)15-24)37-20-31(8)43(32(9)21-37)45-35(12)39-18-26(3)19-40(47-39)36(13)46-44-33(10)22-38(23-34(44)11)42-29(6)16-25(2)17-30(42)7/h9-47H,1-8H3;14-23H,1-13H3/b76-46+,77-47+;45-35+,46-36+
• InChIKey: ZJUMQASECTZRSX-SJSPYHKUSA-N
• XLogP: 32.48
• TPSA: 75.22 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 18
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1626.25
LogP ≤ 5	32.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine?

The IUPAC name of N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine (CID 162140001) is N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine.

What is the SMILES notation for N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine?

The canonical SMILES for N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine is C/C(=N\c1c(C)cc(-c2c(C)cc(C)cc2C)cc1C)c1cc(C)cc(/C(C)=N/c2c(C)cc(-c3c(C)cc(C)cc3C)cc2C)n1.Cc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(C)cc3)c2-c2cc(C)c(/N=C/c3cccc(/C=N/c4c(C)cc(-c5c(-c6ccc(C)cc6)cc(-c6ccccc6)cc5-c5ccc(C)cc5)cc4C)n3)c(C)c2)cc1.

What is the InChIKey of N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine?

The InChIKey is ZJUMQASECTZRSX-SJSPYHKUSA-N. The full InChI is InChI=1S/C75H63N3.C44H49N3/c1-48-22-30-58(31-23-48)68-42-62(56-16-11-9-12-17-56)43-69(59-32-24-49(2)25-33-59)72(68)64-38-52(5)74(53(6)39-64)76-46-66-20-15-21-67(78-66)47-77-75-54(7)40-65(41-55(75)8)73-70(60-34-26-50(3)27-35-60)44-63(57-18-13-10-14-19-57)45-71(73)61-36-28-51(4)29-37-61;1-24-14-27(4)41(28(5)15-24)37-20-31(8)43(32(9)21-37)45-35(12)39-18-26(3)19-40(47-39)36(13)46-44-33(10)22-38(23-34(44)11)42-29(6)16-25(2)17-30(42)7/h9-47H,1-8H3;14-23H,1-13H3/b76-46+,77-47+;45-35+,46-36+.

What are the key properties of N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine?

N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine has a molecular weight of 1626.25 g/mol, XLogP of 32.48, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]-1-[6-[[4-[2,6-bis(4-methylphenyl)-4-phenylphenyl]-2,6-dimethylphenyl]iminomethyl]-2-pyridinyl]methanimine;N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-1-[6-[N-[2,6-dimethyl-4-(2,4,6-trimethylphenyl)phenyl]-C-methylcarbonimidoyl]-4-methyl-2-pyridinyl]ethanimine is sourced from PubChem (CID 162140001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).