N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine

C70H65N — CID 89067284

IUPACN-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine
SMILESCCC1(CC)C2=C(CCC(/C=C/c3ccc(/C=C/c4ccc(-c5ccc(C(C6=CCCC=C6)(C6=CC=CCC6)c6ccccc6)cc5)cc4)cc3)=C2)c2ccc(N(c3ccccc3)C3C=CC=CC3)cc21
InChIInChI=1S/C70H65N/c1-3-69(4-2)67-50-55(40-48-65(67)66-49-47-64(51-68(66)69)71(62-26-16-8-17-27-62)63-28-18-9-19-29-63)37-36-53-32-30-52(31-33-53)34-35-54-38-41-56(42-39-54)57-43-45-61(46-44-57)70(58-20-10-5-11-21-58,59-22-12-6-13-23-59)60-24-14-7-15-25-60/h5-6,8-12,14,16-22,24-28,30-39,41-47,49-51,63H,3-4,7,13,15,23,29,40,48H2,1-2H3/b35-34+,37-36+
InChIKeySANMYKDJVBDUPE-XGMUGIETSA-N
MW920.30 g/mol
LogP18.64
Rot. Bonds14

About N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine

N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine (PubChem CID 89067284) has the molecular formula C70H65N and a molecular weight of 920.30 g/mol. Its IUPAC name is N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine.

Molecular Properties

Compound NameN-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine
PubChem CID89067284
Molecular FormulaC70H65N
Molecular Weight920.30 g/mol
Exact Mass919.51
IUPAC NameN-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine
SMILESCCC1(CC)C2=C(CCC(/C=C/c3ccc(/C=C/c4ccc(-c5ccc(C(C6=CCCC=C6)(C6=CC=CCC6)c6ccccc6)cc5)cc4)cc3)=C2)c2ccc(N(c3ccccc3)C3C=CC=CC3)cc21
InChIInChI=1S/C70H65N/c1-3-69(4-2)67-50-55(40-48-65(67)66-49-47-64(51-68(66)69)71(62-26-16-8-17-27-62)63-28-18-9-19-29-63)37-36-53-32-30-52(31-33-53)34-35-54-38-41-56(42-39-54)57-43-45-61(46-44-57)70(58-20-10-5-11-21-58,59-22-12-6-13-23-59)60-24-14-7-15-25-60/h5-6,8-12,14,16-22,24-28,30-39,41-47,49-51,63H,3-4,7,13,15,23,29,40,48H2,1-2H3/b35-34+,37-36+
InChIKeySANMYKDJVBDUPE-XGMUGIETSA-N
XLogP18.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500920.30
LogP ≤ 518.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine with MolForge

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Related Compounds

7-[(E)-2-[4-[4-[cyclohexa-1,5-dien-1-yl(diphenyl)methyl]phenyl]phenyl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 89067093
N-cyclohexa-2,4-dien-1-yl-9,9-diethyl-N-phenyl-7-[(E)-2-[4-[4-phenyl-2-(2-phenylphenyl)phenyl]phenyl]ethenyl]fluoren-2-amine
CID 89067131
7-[(E)-2-[4-[2-(4-tert-butylphenyl)-6-phenylphenyl]phenyl]ethenyl]-9,9-diethyl-N,N-diphenyl-5,6-dihydrofluoren-2-amine
CID 89067020
N-cyclohexa-1,5-dien-1-yl-N-cyclohexa-2,4-dien-1-yl-4-[(E)-2-[4-(4-phenylphenyl)phenyl]ethenyl]aniline
CID 89189838
N-cyclohexa-2,4-dien-1-yl-7'-[(E)-2-[4-(1-cyclohexa-1,3-dien-1-yl-4-phenyltriphenylen-2-yl)cyclohexen-1-yl]ethenyl]-N-phenylspiro[1,3-dihydroindene-2,9'-3,4-dihydrofluorene]-2'-amine
CID 89066725
CID 89104631
CID 89104631
[cyclohexa-1,3-dien-1-yl-(4-methylcyclohexa-1,5-dien-1-yl)-phenylmethyl]benzene
CID 91587028
1-N-cyclohexa-2,4-dien-1-yl-4-N-[4-(N-cyclohexa-1,5-dien-1-yl-3-methylanilino)phenyl]-1-N-(3-methylphenyl)-4-N-[4-(N-(3-methylphenyl)anilino)cyclohexa-1,3-dien-1-yl]benzene-1,4-diamine
CID 140938297
N-[4-[(E)-2-[9,9-dimethyl-7-(N-phenylanilino)-3,4-dihydrofluoren-2-yl]ethenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 89189714
N-cyclohexa-2,4-dien-1-yl-N-(4-cyclohexa-1,5-dien-1-ylphenyl)-7-(3,4-dihydrocarbazol-9-yl)-9,9-dimethylfluoren-2-amine
CID 131994219
N-cyclohexa-1,5-dien-1-yl-7-[(E)-2-[6-(6,7-diphenylnaphthalen-2-yl)naphthalen-2-yl]ethenyl]-N-phenylspiro[5,6-dihydrofluorene-9,1'-cyclohexane]-2-amine
CID 89066714
7-(N-cyclohexa-1,5-dien-1-ylanilino)-9,9-dimethyl-3,4-dihydrofluorene-2-carbaldehyde
CID 89067073

Frequently Asked Questions

What is the IUPAC name of N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine?
The IUPAC name of N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine (CID 89067284) is N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine.
What is the SMILES notation for N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine?
The canonical SMILES for N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine is CCC1(CC)C2=C(CCC(/C=C/c3ccc(/C=C/c4ccc(-c5ccc(C(C6=CCCC=C6)(C6=CC=CCC6)c6ccccc6)cc5)cc4)cc3)=C2)c2ccc(N(c3ccccc3)C3C=CC=CC3)cc21.
What is the InChIKey of N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine?
The InChIKey is SANMYKDJVBDUPE-XGMUGIETSA-N. The full InChI is InChI=1S/C70H65N/c1-3-69(4-2)67-50-55(40-48-65(67)66-49-47-64(51-68(66)69)71(62-26-16-8-17-27-62)63-28-18-9-19-29-63)37-36-53-32-30-52(31-33-53)34-35-54-38-41-56(42-39-54)57-43-45-61(46-44-57)70(58-20-10-5-11-21-58,59-22-12-6-13-23-59)60-24-14-7-15-25-60/h5-6,8-12,14,16-22,24-28,30-39,41-47,49-51,63H,3-4,7,13,15,23,29,40,48H2,1-2H3/b35-34+,37-36+.
What are the key properties of N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine?
N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine has a molecular weight of 920.30 g/mol, XLogP of 18.64, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexa-2,4-dien-1-yl-7-[(E)-2-[4-[(E)-2-[4-[4-(cyclohexa-1,3-dien-1-yl-cyclohexa-1,5-dien-1-yl-phenylmethyl)phenyl]phenyl]ethenyl]phenyl]ethenyl]-9,9-diethyl-N-phenyl-5,6-dihydrofluoren-2-amine is sourced from PubChem (CID 89067284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).