N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline

C61H55N — CID 134272422

IUPACN-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline
SMILESCc1ccc(C(c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C/c5ccc(N(c6ccc(C)cc6)c6ccc(C)c(C)c6)cc5)cc4)cc3)cc2)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C61H55N/c1-43-7-31-55(32-8-43)61(57-33-11-45(3)47(5)41-57)56-34-27-53(28-35-56)25-23-51-19-15-49(16-20-51)13-14-50-17-21-52(22-18-50)24-26-54-29-39-59(40-30-54)62(58-36-9-44(2)10-37-58)60-38-12-46(4)48(6)42-60/h7-42,61H,1-6H3/b14-13+,25-23+,26-24+
InChIKeyJGKWZNGCDOUONG-GCYCSIMGSA-N
MW802.12 g/mol
LogP16.70
Rot. Bonds12

About N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline

N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline (PubChem CID 134272422) has the molecular formula C61H55N and a molecular weight of 802.12 g/mol. Its IUPAC name is N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound NameN-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline
PubChem CID134272422
Molecular FormulaC61H55N
Molecular Weight802.12 g/mol
Exact Mass801.43
IUPAC NameN-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline
SMILESCc1ccc(C(c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C/c5ccc(N(c6ccc(C)cc6)c6ccc(C)c(C)c6)cc5)cc4)cc3)cc2)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C61H55N/c1-43-7-31-55(32-8-43)61(57-33-11-45(3)47(5)41-57)56-34-27-53(28-35-56)25-23-51-19-15-49(16-20-51)13-14-50-17-21-52(22-18-50)24-26-54-29-39-59(40-30-54)62(58-36-9-44(2)10-37-58)60-38-12-46(4)48(6)42-60/h7-42,61H,1-6H3/b14-13+,25-23+,26-24+
InChIKeyJGKWZNGCDOUONG-GCYCSIMGSA-N
XLogP16.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500802.12
LogP ≤ 516.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline with MolForge

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Related Compounds

N-[4-[2-[4-(N-(3,4-dimethylphenyl)-4-methylanilino)phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline
CID 123191031
N-[4-[2-[4-[bis(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 76600737
N-[4-[2-[4-[2-[4-[bis(4-methylphenyl)methyl]phenyl]ethenyl]-2,5-dimethylphenyl]ethenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 59366099
N-(3,4-dimethylphenyl)-3,4-dimethyl-N-(4-methylphenyl)aniline;ethane
CID 143481987
methane;3-methyl-N,N-bis(4-methylphenyl)-4-[(E)-2-(4-methylphenyl)ethenyl]aniline
CID 158838824
ethane;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 143133606
4-methyl-N,N-bis[4-[2-[4-(4-methylphenyl)phenyl]ethenyl]phenyl]aniline
CID 59805421
3-methyl-4-[2-[4-[2-[2-methyl-4-(N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]-N-(4-methylphenyl)-N-phenylaniline
CID 59805392
N-[4-[2-[6-[2-[4-(N-(3,4-dimethylphenyl)anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-3,4-dimethyl-N-phenylaniline
CID 59933553
3-[(E)-2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]-N-[3-[(E)-2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline
CID 118136756
4-[bis(3,4-dimethylphenyl)methyl]benzaldehyde
CID 44551381
4-methyl-N-[4-[(E)-2-[3-methyl-4-[(E)-2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline
CID 20734404

Frequently Asked Questions

What is the IUPAC name of N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline?
The IUPAC name of N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline (CID 134272422) is N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline?
The canonical SMILES for N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline is Cc1ccc(C(c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C/c5ccc(N(c6ccc(C)cc6)c6ccc(C)c(C)c6)cc5)cc4)cc3)cc2)c2ccc(C)c(C)c2)cc1.
What is the InChIKey of N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline?
The InChIKey is JGKWZNGCDOUONG-GCYCSIMGSA-N. The full InChI is InChI=1S/C61H55N/c1-43-7-31-55(32-8-43)61(57-33-11-45(3)47(5)41-57)56-34-27-53(28-35-56)25-23-51-19-15-49(16-20-51)13-14-50-17-21-52(22-18-50)24-26-54-29-39-59(40-30-54)62(58-36-9-44(2)10-37-58)60-38-12-46(4)48(6)42-60/h7-42,61H,1-6H3/b14-13+,25-23+,26-24+.
What are the key properties of N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline?
N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline has a molecular weight of 802.12 g/mol, XLogP of 16.70, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(E)-2-[4-[(E)-2-[4-[(E)-2-[4-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]ethenyl]phenyl]-3,4-dimethyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 134272422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).