9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine

C59H46N2 — CID 135163375

IUPAC9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine
SMILESCc1cc(C)cc(-c2ccc3c(c2)C(C)(C)c2cc(-n4c5ccccc5c5cc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccccc7)cc6)ccc54)ccc2-3)c1
InChIInChI=1S/C59H46N2/c1-39-33-40(2)35-46(34-39)45-23-30-51-52-31-28-50(38-56(52)59(3,4)55(51)36-45)61-57-18-12-11-17-53(57)54-37-49(29-32-58(54)61)60(47-24-19-43(20-25-47)41-13-7-5-8-14-41)48-26-21-44(22-27-48)42-15-9-6-10-16-42/h5-38H,1-4H3
InChIKeyOZMQDZRMXVUQHG-UHFFFAOYSA-N
MW783.03 g/mol
LogP16.18
Rot. Bonds7

About 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine

9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine (PubChem CID 135163375) has the molecular formula C59H46N2 and a molecular weight of 783.03 g/mol. Its IUPAC name is 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound Name9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine
PubChem CID135163375
Molecular FormulaC59H46N2
Molecular Weight783.03 g/mol
Exact Mass782.37
IUPAC Name9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine
SMILESCc1cc(C)cc(-c2ccc3c(c2)C(C)(C)c2cc(-n4c5ccccc5c5cc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccccc7)cc6)ccc54)ccc2-3)c1
InChIInChI=1S/C59H46N2/c1-39-33-40(2)35-46(34-39)45-23-30-51-52-31-28-50(38-56(52)59(3,4)55(51)36-45)61-57-18-12-11-17-53(57)54-37-49(29-32-58(54)61)60(47-24-19-43(20-25-47)41-13-7-5-8-14-41)48-26-21-44(22-27-48)42-15-9-6-10-16-42/h5-38H,1-4H3
InChIKeyOZMQDZRMXVUQHG-UHFFFAOYSA-N
XLogP16.18
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500783.03
LogP ≤ 516.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-carbazol-9-yl-N-[4-(3,5-dimethylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 134370655
N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158799608
7-carbazol-9-yl-N-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 134370640
N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-2-N,2-N,7-N,7-N-tetrakis(4-phenylphenyl)fluorene-2,7-diamine;7-(3,6-diphenylcarbazol-9-yl)-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158713660
9,9-dimethyl-N-phenyl-7-(3-phenylcarbazol-9-yl)-N-[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390145
9,9-dimethyl-N-phenyl-7-(3-phenylcarbazol-9-yl)-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 58390142
4-methyl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]-N-[4-(7,9,9-trimethylfluoren-2-yl)phenyl]aniline
CID 170261145
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390067
N-[9,9-dimethyl-7-(9-phenylcarbazol-3-yl)fluoren-2-yl]-9,9-dimethyl-7-(9-phenylcarbazol-3-yl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 87412305
2-carbazol-9-yl-9-[7-(2-carbazol-9-ylcarbazol-9-yl)-9,9-dimethylfluoren-2-yl]carbazole;2-carbazol-9-yl-9-[4-(2-carbazol-9-yl-6-phenylcarbazol-9-yl)phenyl]-6-phenylcarbazole;9-[9,9-dimethyl-7-[2-(N-phenylanilino)carbazol-9-yl]fluoren-2-yl]-N,N-diphenylcarbazol-2-amine;9-[9-[4-[2-(3,6-diphenylcarbazol-9-yl)carbazol-9-yl]phenyl]carbazol-2-yl]-3,6-diphenylcarbazole
CID 158084522
N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 158875006
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-phenyl-7-(9-phenylcarbazol-3-yl)fluoren-2-amine
CID 71038279

Frequently Asked Questions

What is the IUPAC name of 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine (CID 135163375) is 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine is Cc1cc(C)cc(-c2ccc3c(c2)C(C)(C)c2cc(-n4c5ccccc5c5cc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccccc7)cc6)ccc54)ccc2-3)c1.
What is the InChIKey of 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine?
The InChIKey is OZMQDZRMXVUQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H46N2/c1-39-33-40(2)35-46(34-39)45-23-30-51-52-31-28-50(38-56(52)59(3,4)55(51)36-45)61-57-18-12-11-17-53(57)54-37-49(29-32-58(54)61)60(47-24-19-43(20-25-47)41-13-7-5-8-14-41)48-26-21-44(22-27-48)42-15-9-6-10-16-42/h5-38H,1-4H3.
What are the key properties of 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine?
9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine has a molecular weight of 783.03 g/mol, XLogP of 16.18, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]-N,N-bis(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 135163375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).