N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline

C180H150N12 — CID 160714078

About N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline

N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline (PubChem CID 160714078) has the molecular formula C180H150N12 and a molecular weight of 2481.26 g/mol. Its IUPAC name is N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline.

Molecular Properties

• Compound Name: N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline
• PubChem CID: 160714078
• Molecular Formula: C180H150N12
• Molecular Weight: 2481.26 g/mol
• Exact Mass: 2479.21
• IUPAC Name: N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline
• SMILES: CCCCc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(CC)cc4)c4ccc(CCCC)cc4)cc3)cc2)cc1.c1ccc(N=C(c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(N=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1
• InChI: InChI=1S/C91H69N7.C46H48N2.C43H33N3/c1-10-28-72(29-11-1)92-91(70-46-50-81(51-47-70)97(87-62-54-83(55-63-87)93(73-30-12-2-13-31-73)74-32-14-3-15-33-74)88-64-56-84(57-65-88)94(75-34-16-4-17-35-75)76-36-18-5-19-37-76)71-48-52-82(53-49-71)98(89-66-58-85(59-67-89)95(77-38-20-6-21-39-77)78-40-22-7-23-41-78)90-68-60-86(61-69-90)96(79-42-24-8-25-43-79)80-44-26-9-27-45-80;1-4-7-12-37-18-28-43(29-19-37)47(41-14-10-9-11-15-41)45-32-22-39(23-33-45)40-24-34-46(35-25-40)48(42-26-16-36(6-3)17-27-42)44-30-20-38(21-31-44)13-8-5-2;1-6-16-36(17-7-1)44-43(34-26-30-41(31-27-34)45(37-18-8-2-9-19-37)38-20-10-3-11-21-38)35-28-32-42(33-29-35)46(39-22-12-4-13-23-39)40-24-14-5-15-25-40/h1-69H;9-11,14-35H,4-8,12-13H2,1-3H3;1-33H
• InChIKey: RSFWIMRLXJQYOT-UHFFFAOYSA-N
• XLogP: 51.01
• TPSA: 57.12 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 44
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2481.26
LogP ≤ 5	51.01
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline?

The IUPAC name of N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline (CID 160714078) is N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline.

What is the SMILES notation for N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline?

The canonical SMILES for N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline is CCCCc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(CC)cc4)c4ccc(CCCC)cc4)cc3)cc2)cc1.c1ccc(N=C(c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(N=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1.

What is the InChIKey of N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline?

The InChIKey is RSFWIMRLXJQYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C91H69N7.C46H48N2.C43H33N3/c1-10-28-72(29-11-1)92-91(70-46-50-81(51-47-70)97(87-62-54-83(55-63-87)93(73-30-12-2-13-31-73)74-32-14-3-15-33-74)88-64-56-84(57-65-88)94(75-34-16-4-17-35-75)76-36-18-5-19-37-76)71-48-52-82(53-49-71)98(89-66-58-85(59-67-89)95(77-38-20-6-21-39-77)78-40-22-7-23-41-78)90-68-60-86(61-69-90)96(79-42-24-8-25-43-79)80-44-26-9-27-45-80;1-4-7-12-37-18-28-43(29-19-37)47(41-14-10-9-11-15-41)45-32-22-39(23-33-45)40-24-34-46(35-25-40)48(42-26-16-36(6-3)17-27-42)44-30-20-38(21-31-44)13-8-5-2;1-6-16-36(17-7-1)44-43(34-26-30-41(31-27-34)45(37-18-8-2-9-19-37)38-20-10-3-11-21-38)35-28-32-42(33-29-35)46(39-22-12-4-13-23-39)40-24-14-5-15-25-40/h1-69H;9-11,14-35H,4-8,12-13H2,1-3H3;1-33H.

What are the key properties of N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline?

N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline has a molecular weight of 2481.26 g/mol, XLogP of 51.01, 44 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-butylphenyl)-N-[4-[4-(N-(4-butylphenyl)anilino)phenyl]phenyl]-4-ethylaniline;1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]-4-N-[4-[N-phenyl-C-[4-[4-(N-phenylanilino)-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]carbonimidoyl]phenyl]benzene-1,4-diamine;N,N-diphenyl-4-[N-phenyl-C-[4-(N-phenylanilino)phenyl]carbonimidoyl]aniline is sourced from PubChem (CID 160714078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).