5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

C69H52N2 — CID 166895480

IUPAC5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(C2(c3ccc(C)cc3)c3cc(N(C4=C(c5ccccc5)CC(c5ccccc5)C=C4)c4ccc(-c5ccccc5)cc4)ccc3-c3c(-n4c5ccccc5c5ccccc54)cccc32)cc1
InChIInChI=1S/C69H52N2/c1-47-29-36-54(37-30-47)69(55-38-31-48(2)32-39-55)62-25-16-28-67(71-64-26-14-12-23-58(64)59-24-13-15-27-65(59)71)68(62)60-43-42-57(46-63(60)69)70(56-40-33-51(34-41-56)49-17-6-3-7-18-49)66-44-35-53(50-19-8-4-9-20-50)45-61(66)52-21-10-5-11-22-52/h3-44,46,53H,45H2,1-2H3
InChIKeyHCSFFGDDGLQRJB-UHFFFAOYSA-N
MW909.19 g/mol
LogP17.72
Rot. Bonds9

About 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 166895480) has the molecular formula C69H52N2 and a molecular weight of 909.19 g/mol. Its IUPAC name is 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID166895480
Molecular FormulaC69H52N2
Molecular Weight909.19 g/mol
Exact Mass908.41
IUPAC Name5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(C2(c3ccc(C)cc3)c3cc(N(C4=C(c5ccccc5)CC(c5ccccc5)C=C4)c4ccc(-c5ccccc5)cc4)ccc3-c3c(-n4c5ccccc5c5ccccc54)cccc32)cc1
InChIInChI=1S/C69H52N2/c1-47-29-36-54(37-30-47)69(55-38-31-48(2)32-39-55)62-25-16-28-67(71-64-26-14-12-23-58(64)59-24-13-15-27-65(59)71)68(62)60-43-42-57(46-63(60)69)70(56-40-33-51(34-41-56)49-17-6-3-7-18-49)66-44-35-53(50-19-8-4-9-20-50)45-61(66)52-21-10-5-11-22-52/h3-44,46,53H,45H2,1-2H3
InChIKeyHCSFFGDDGLQRJB-UHFFFAOYSA-N
XLogP17.72
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500909.19
LogP ≤ 517.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine with MolForge

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Related Compounds

9-(4-methylphenyl)-7,9-diphenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine
CID 90277846
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 118349357
N-(4-phenylphenyl)-N-[4-[6-phenyl-9-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 142391304
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118349359
N-[4-[3-[9-(9,9-diphenylfluoren-4-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine
CID 118462558
N-[4-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 118337172
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline
CID 118349360
N-[4-[3-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 167322443
N-(5-carbazol-9-yl-9,9-diphenylfluoren-2-yl)-N-phenyldibenzothiophen-2-amine;N-(5-carbazol-9-yl-9,9-diphenylfluoren-2-yl)-N-phenyl-9-(4-phenylphenyl)carbazol-2-amine
CID 158224602
N-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 122414007
N-[2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 118265653
2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 118265642

Frequently Asked Questions

What is the IUPAC name of 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (CID 166895480) is 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is Cc1ccc(C2(c3ccc(C)cc3)c3cc(N(C4=C(c5ccccc5)CC(c5ccccc5)C=C4)c4ccc(-c5ccccc5)cc4)ccc3-c3c(-n4c5ccccc5c5ccccc54)cccc32)cc1.
What is the InChIKey of 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is HCSFFGDDGLQRJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H52N2/c1-47-29-36-54(37-30-47)69(55-38-31-48(2)32-39-55)62-25-16-28-67(71-64-26-14-12-23-58(64)59-24-13-15-27-65(59)71)68(62)60-43-42-57(46-63(60)69)70(56-40-33-51(34-41-56)49-17-6-3-7-18-49)66-44-35-53(50-19-8-4-9-20-50)45-61(66)52-21-10-5-11-22-52/h3-44,46,53H,45H2,1-2H3.
What are the key properties of 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 909.19 g/mol, XLogP of 17.72, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 166895480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).