2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine

C105H93N3 — CID 20733709

IUPAC2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine
SMILESC(=C1CCCCC1)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccc4c(c3)-c3ccccc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(CC7CCCCC7)cc6)cc5)cc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(C=C7CCCCC7)cc6)cc5)cc3-4)cc2)cc1
InChIInChI=1S/C105H93N3/c1-7-21-83(22-8-1)71-86-47-41-77(42-48-86)35-38-80-53-59-92(60-54-80)106(89-27-13-4-14-28-89)95-65-68-100-98-33-19-20-34-99(98)103-74-96(107(90-29-15-5-16-30-90)93-61-55-81(56-62-93)39-36-78-43-49-87(50-44-78)72-84-23-9-2-10-24-84)66-69-101(103)105-76-97(67-70-102(105)104(100)75-95)108(91-31-17-6-18-32-91)94-63-57-82(58-64-94)40-37-79-45-51-88(52-46-79)73-85-25-11-3-12-26-85/h4-6,13-20,27-70,72-76,83H,1-3,7-12,21-26,71H2/b38-35+,39-36+,40-37+,100-98-,103-99-,104-102-,105-101-
InChIKeyUZLPPCWKTKCZAX-MIHYVOIYSA-N
MW1396.92 g/mol
LogP30.41
Rot. Bonds19

About 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine

2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine (PubChem CID 20733709) has the molecular formula C105H93N3 and a molecular weight of 1396.92 g/mol. Its IUPAC name is 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine.

Molecular Properties

Compound Name2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine
PubChem CID20733709
Molecular FormulaC105H93N3
Molecular Weight1396.92 g/mol
Exact Mass1395.74
IUPAC Name2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine
SMILESC(=C1CCCCC1)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccc4c(c3)-c3ccccc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(CC7CCCCC7)cc6)cc5)cc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(C=C7CCCCC7)cc6)cc5)cc3-4)cc2)cc1
InChIInChI=1S/C105H93N3/c1-7-21-83(22-8-1)71-86-47-41-77(42-48-86)35-38-80-53-59-92(60-54-80)106(89-27-13-4-14-28-89)95-65-68-100-98-33-19-20-34-99(98)103-74-96(107(90-29-15-5-16-30-90)93-61-55-81(56-62-93)39-36-78-43-49-87(50-44-78)72-84-23-9-2-10-24-84)66-69-101(103)105-76-97(67-70-102(105)104(100)75-95)108(91-31-17-6-18-32-91)94-63-57-82(58-64-94)40-37-79-45-51-88(52-46-79)73-85-25-11-3-12-26-85/h4-6,13-20,27-70,72-76,83H,1-3,7-12,21-26,71H2/b38-35+,39-36+,40-37+,100-98-,103-99-,104-102-,105-101-
InChIKeyUZLPPCWKTKCZAX-MIHYVOIYSA-N
XLogP30.41
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms108
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001396.92
LogP ≤ 530.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine with MolForge

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Related Compounds

14-N-[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N,14-N-tetrakis(4-methylphenyl)-2-N,6-N,10-N-tris[4-[(E)-2-(4-methylphenyl)ethenyl]phenyl]tetraphenylene-2,6,10,14-tetramine
CID 20733676
6-N-[4-(cyclohexylidenemethyl)phenyl]-2-N,2-N,6-N-tris(4-methylphenyl)tetraphenylene-2,6-diamine
CID 20733792
N,N-bis[4-(cyclohexylidenemethyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 20733834
N-[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-N-(4-methylphenyl)triphenylen-2-amine
CID 20733776
N,N-bis[4-(cyclopentylmethyl)phenyl]-4-ethylaniline
CID 58420731
N,N-diphenyl-4-[2-[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethyl]aniline
CID 76639574
9-N,9-N,10-N,10-N-tetrakis[4-(cyclohexylidenemethyl)phenyl]anthracene-9,10-diamine
CID 20733877
1-N,1-N,4-N-triphenyl-4-N-[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]benzene-1,4-diamine
CID 66641192
N,N-diphenyl-4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-[4-[(E)-2-[4-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]anilino)phenyl]ethenyl]phenyl]ethenyl]aniline
CID 177478696
N,N-diphenyl-4-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]aniline
CID 139195314
4-ethyl-N-[4-[(E)-2-[4-(N-(4-ethylphenyl)anilino)phenyl]ethenyl]phenyl]-N-phenylaniline
CID 59722336
4-benzyl-N-[4-[2-[4-[2-[4-(N-(4-benzylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-phenylaniline
CID 59922719

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine?
The IUPAC name of 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine (CID 20733709) is 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine.
What is the SMILES notation for 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine?
The canonical SMILES for 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine is C(=C1CCCCC1)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccc4c(c3)-c3ccccc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(CC7CCCCC7)cc6)cc5)cc3-c3ccc(N(c5ccccc5)c5ccc(/C=C/c6ccc(C=C7CCCCC7)cc6)cc5)cc3-4)cc2)cc1.
What is the InChIKey of 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine?
The InChIKey is UZLPPCWKTKCZAX-MIHYVOIYSA-N. The full InChI is InChI=1S/C105H93N3/c1-7-21-83(22-8-1)71-86-47-41-77(42-48-86)35-38-80-53-59-92(60-54-80)106(89-27-13-4-14-28-89)95-65-68-100-98-33-19-20-34-99(98)103-74-96(107(90-29-15-5-16-30-90)93-61-55-81(56-62-93)39-36-78-43-49-87(50-44-78)72-84-23-9-2-10-24-84)66-69-101(103)105-76-97(67-70-102(105)104(100)75-95)108(91-31-17-6-18-32-91)94-63-57-82(58-64-94)40-37-79-45-51-88(52-46-79)73-85-25-11-3-12-26-85/h4-6,13-20,27-70,72-76,83H,1-3,7-12,21-26,71H2/b38-35+,39-36+,40-37+,100-98-,103-99-,104-102-,105-101-.
What are the key properties of 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine?
2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine has a molecular weight of 1396.92 g/mol, XLogP of 30.41, 19 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis[4-[(E)-2-[4-(cyclohexylidenemethyl)phenyl]ethenyl]phenyl]-10-N-[4-[(E)-2-[4-(cyclohexylmethyl)phenyl]ethenyl]phenyl]-2-N,6-N,10-N-triphenyltetraphenylene-2,6,10-triamine is sourced from PubChem (CID 20733709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).