N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline

C132H114N4 — CID 159382717

IUPACN-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CC(C)=CN(c1ccccc1)c1ccc(CC(c2ccccc2)c2ccccc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=CC=C(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C36H31N.C34H29N.C32H25N.C30H29N/c1-28-16-22-33(23-17-28)37(34-24-18-29(2)19-25-34)35-26-20-30(21-27-35)10-9-15-36(31-11-5-3-6-12-31)32-13-7-4-8-14-32;1-26-13-19-31(20-14-26)35(32-21-15-27(2)16-22-32)33-23-17-28(18-24-33)25-34(29-9-5-3-6-10-29)30-11-7-4-8-12-30;1-5-13-27(14-6-1)32(28-15-7-2-8-16-28)25-26-21-23-31(24-22-26)33(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-24(2)23-31(28-16-10-5-11-17-28)29-20-18-25(19-21-29)22-30(26-12-6-3-7-13-26)27-14-8-4-9-15-27/h3-27H,1-2H3;3-25H,1-2H3;1-25H;3-21,23,30H,22H2,1-2H3
InChIKeyLLCQXPXMGKCYIT-UHFFFAOYSA-N
MW1756.39 g/mol
LogP36.15
Rot. Bonds26

About N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline

N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline (PubChem CID 159382717) has the molecular formula C132H114N4 and a molecular weight of 1756.39 g/mol. Its IUPAC name is N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline.

Molecular Properties

Compound NameN-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline
PubChem CID159382717
Molecular FormulaC132H114N4
Molecular Weight1756.39 g/mol
Exact Mass1754.90
IUPAC NameN-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CC(C)=CN(c1ccccc1)c1ccc(CC(c2ccccc2)c2ccccc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=CC=C(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C36H31N.C34H29N.C32H25N.C30H29N/c1-28-16-22-33(23-17-28)37(34-24-18-29(2)19-25-34)35-26-20-30(21-27-35)10-9-15-36(31-11-5-3-6-12-31)32-13-7-4-8-14-32;1-26-13-19-31(20-14-26)35(32-21-15-27(2)16-22-32)33-23-17-28(18-24-33)25-34(29-9-5-3-6-10-29)30-11-7-4-8-12-30;1-5-13-27(14-6-1)32(28-15-7-2-8-16-28)25-26-21-23-31(24-22-26)33(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-24(2)23-31(28-16-10-5-11-17-28)29-20-18-25(19-21-29)22-30(26-12-6-3-7-13-26)27-14-8-4-9-15-27/h3-27H,1-2H3;3-25H,1-2H3;1-25H;3-21,23,30H,22H2,1-2H3
InChIKeyLLCQXPXMGKCYIT-UHFFFAOYSA-N
XLogP36.15
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds26
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001756.39
LogP ≤ 536.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[2-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]ethenyl]phenyl]-4-[2-(4-methylphenyl)ethenyl]-N-phenylaniline
CID 155077496
4-(4,4-diphenylbuta-1,3-dienyl)-N,N-bis[4-(2,2-diphenylethenyl)phenyl]aniline
CID 54461178
4-[(1E)-4,4-diphenylbuta-1,3-dienyl]-N-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-N-phenylaniline
CID 23371223
4-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-N-[4-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]phenyl]-N-phenylaniline
CID 87948616
4-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-N,N-diphenylaniline
CID 23069421
4-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-N-[4-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]phenyl]-N-phenylaniline
CID 91386727
4-(4,4-diphenylbuta-1,3-dienyl)-N,N-bis[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]aniline;ethane
CID 163992333
4-methyl-N-(4-methylphenyl)-N-[4-[(E)-2-(4-methylphenyl)-1-phenylethenyl]phenyl]aniline
CID 58841601
N,N-bis[4-[2,2-bis(4-methylphenyl)ethenyl]phenyl]-4-methylaniline;N,N-bis[4-(2,2-diphenylethenyl)phenyl]-4-methylaniline;4-[4,4-bis(4-methylphenyl)buta-1,3-dienyl]-N-(4-methoxyphenyl)aniline;4-(4,4-diphenylbuta-1,3-dienyl)-N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-N-phenylaniline
CID 90960262
N-[2,2-bis(4-fluorophenyl)ethenyl]-N-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-4-methylaniline
CID 23517958
N-[2,2-bis(4-bromophenyl)ethenyl]-4-[(1E)-4,4-bis(4-methylphenyl)buta-1,3-dienyl]-N-phenylaniline
CID 23517941
N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[(E)-2-[2-[(E)-2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline;4-methyl-N-[4-[(E)-2-[4-[(E)-2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline
CID 159829697

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline?
The IUPAC name of N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline (CID 159382717) is N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline.
What is the SMILES notation for N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline?
The canonical SMILES for N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline is C(=C(c1ccccc1)c1ccccc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CC(C)=CN(c1ccccc1)c1ccc(CC(c2ccccc2)c2ccccc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=CC=C(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline?
The InChIKey is LLCQXPXMGKCYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H31N.C34H29N.C32H25N.C30H29N/c1-28-16-22-33(23-17-28)37(34-24-18-29(2)19-25-34)35-26-20-30(21-27-35)10-9-15-36(31-11-5-3-6-12-31)32-13-7-4-8-14-32;1-26-13-19-31(20-14-26)35(32-21-15-27(2)16-22-32)33-23-17-28(18-24-33)25-34(29-9-5-3-6-10-29)30-11-7-4-8-12-30;1-5-13-27(14-6-1)32(28-15-7-2-8-16-28)25-26-21-23-31(24-22-26)33(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-24(2)23-31(28-16-10-5-11-17-28)29-20-18-25(19-21-29)22-30(26-12-6-3-7-13-26)27-14-8-4-9-15-27/h3-27H,1-2H3;3-25H,1-2H3;1-25H;3-21,23,30H,22H2,1-2H3.
What are the key properties of N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline?
N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline has a molecular weight of 1756.39 g/mol, XLogP of 36.15, 26 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethenyl)-N,N-diphenylaniline;N-[4-(2,2-diphenylethenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-(2,2-diphenylethyl)-N-(2-methylprop-1-enyl)-N-phenylaniline is sourced from PubChem (CID 159382717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).