9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine

C66H53N — CID 91405868

IUPAC9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine
SMILESCCC1(CC)c2cc(C=Cc3ccc(-c4ccc(C(c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccccc34)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C66H53N/c1-3-65(4-2)63-46-48(35-43-61(63)62-45-42-57(47-64(62)65)67(55-28-16-8-17-29-55)56-30-18-9-19-31-56)34-36-49-39-44-59(60-33-21-20-32-58(49)60)50-37-40-54(41-38-50)66(51-22-10-5-11-23-51,52-24-12-6-13-25-52)53-26-14-7-15-27-53/h5-47H,3-4H2,1-2H3
InChIKeyGOYQOUQZDISPKZ-UHFFFAOYSA-N
MW860.16 g/mol
LogP17.62
Rot. Bonds12

About 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine

9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine (PubChem CID 91405868) has the molecular formula C66H53N and a molecular weight of 860.16 g/mol. Its IUPAC name is 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine
PubChem CID91405868
Molecular FormulaC66H53N
Molecular Weight860.16 g/mol
Exact Mass859.42
IUPAC Name9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine
SMILESCCC1(CC)c2cc(C=Cc3ccc(-c4ccc(C(c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccccc34)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C66H53N/c1-3-65(4-2)63-46-48(35-43-61(63)62-45-42-57(47-64(62)65)67(55-28-16-8-17-29-55)56-30-18-9-19-31-56)34-36-49-39-44-59(60-33-21-20-32-58(49)60)50-37-40-54(41-38-50)66(51-22-10-5-11-23-51,52-24-12-6-13-25-52)53-26-14-7-15-27-53/h5-47H,3-4H2,1-2H3
InChIKeyGOYQOUQZDISPKZ-UHFFFAOYSA-N
XLogP17.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500860.16
LogP ≤ 517.62
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 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine 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

9,9-diethyl-N,N-diphenyl-7-[(E)-2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine
CID 89074836
7-[(E)-2-[7-[(E)-2-[9,9-diethyl-7-(N-phenylanilino)fluoren-2-yl]ethenyl]-9,9-diethylfluoren-2-yl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 101497253
7-[(E)-2-[4-[2-(4-tert-butylphenyl)-4-phenylphenyl]phenyl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 89067107
9,9-diethyl-N,N-diphenyl-7-[(E)-2-[4-(10-phenylphenanthren-9-yl)phenyl]ethenyl]fluoren-2-amine
CID 89075006
7-[2-[4-(2,3-dimethyl-4-phenylphenyl)phenyl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 91004917
7-[(E)-2-[4-(2,3-dimethyl-4-phenylphenyl)phenyl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 89074843
9,9-diethyl-N,N-diphenyl-7-[2-[3-(4-phenylphenyl)naphthalen-2-yl]ethenyl]fluoren-2-amine
CID 91243704
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
7-[(E)-2-[4-[(E)-2-[7-(4-tert-butyl-N-(4-tert-butylphenyl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]naphthalen-1-yl]ethenyl]-N,N-bis(4-tert-butylphenyl)-9,9-dimethylfluoren-2-amine
CID 59246573
9,9-diethyl-7-[(E)-2-[4-(4-methyl-2-phenylphenyl)phenyl]ethenyl]-N,N-diphenylfluoren-2-amine
CID 89067087
7-[2-[4-(2,6-dimethyl-3-phenylphenyl)phenyl]ethenyl]-9,9-diethyl-N,N-diphenylfluoren-2-amine
CID 91384887
9,9-diethyl-N-phenyl-7-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-N-(4-trimethylsilylphenyl)fluoren-2-amine
CID 58444639

Frequently Asked Questions

What is the IUPAC name of 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine?
The IUPAC name of 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine (CID 91405868) is 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine?
The canonical SMILES for 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine is CCC1(CC)c2cc(C=Cc3ccc(-c4ccc(C(c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccccc34)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine?
The InChIKey is GOYQOUQZDISPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H53N/c1-3-65(4-2)63-46-48(35-43-61(63)62-45-42-57(47-64(62)65)67(55-28-16-8-17-29-55)56-30-18-9-19-31-56)34-36-49-39-44-59(60-33-21-20-32-58(49)60)50-37-40-54(41-38-50)66(51-22-10-5-11-23-51,52-24-12-6-13-25-52)53-26-14-7-15-27-53/h5-47H,3-4H2,1-2H3.
What are the key properties of 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine?
9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine has a molecular weight of 860.16 g/mol, XLogP of 17.62, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diethyl-N,N-diphenyl-7-[2-[4-(4-tritylphenyl)naphthalen-1-yl]ethenyl]fluoren-2-amine is sourced from PubChem (CID 91405868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).