N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine

C62H44N2 — CID 170119206

IUPACN-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2ccc(N(c3ccccc3-c3ccccc3-c3ccccc3-c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc21
InChIInChI=1S/C62H44N2/c1-62(44-24-7-3-8-25-44)56-36-18-15-32-51(56)52-41-40-46(42-57(52)62)63(60-39-21-35-55-54-34-17-20-38-59(54)64(61(55)60)45-26-9-4-10-27-45)58-37-19-16-33-53(58)50-31-14-13-30-49(50)48-29-12-11-28-47(48)43-22-5-2-6-23-43/h2-42H,1H3
InChIKeyHJJXAEHUPQCYGN-UHFFFAOYSA-N
MW817.05 g/mol
LogP16.59
Rot. Bonds8

About N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine

N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine (PubChem CID 170119206) has the molecular formula C62H44N2 and a molecular weight of 817.05 g/mol. Its IUPAC name is N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine.

Molecular Properties

Compound NameN-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
PubChem CID170119206
Molecular FormulaC62H44N2
Molecular Weight817.05 g/mol
Exact Mass816.35
IUPAC NameN-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2ccc(N(c3ccccc3-c3ccccc3-c3ccccc3-c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc21
InChIInChI=1S/C62H44N2/c1-62(44-24-7-3-8-25-44)56-36-18-15-32-51(56)52-41-40-46(42-57(52)62)63(60-39-21-35-55-54-34-17-20-38-59(54)64(61(55)60)45-26-9-4-10-27-45)58-37-19-16-33-53(58)50-31-14-13-30-49(50)48-29-12-11-28-47(48)43-22-5-2-6-23-43/h2-42H,1H3
InChIKeyHJJXAEHUPQCYGN-UHFFFAOYSA-N
XLogP16.59
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500817.05
LogP ≤ 516.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 170112904
N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
CID 170119634
N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-(2-phenylphenyl)carbazol-1-amine
CID 155004211
9-methyl-9-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170304175
2-(9-methyl-9-phenylfluoren-4-yl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170304285
9-methyl-9-phenyl-N-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170304172
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(2-phenylphenyl)fluoren-2-amine
CID 177080212
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 168790284
9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 170111185
9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]-N-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)carbazol-1-amine
CID 170118881
N-[4-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170304295
N-(9,9-dimethylfluoren-2-yl)-6-fluoro-9-phenyl-N-(9-phenylcarbazol-1-yl)carbazol-1-amine
CID 138549073

Frequently Asked Questions

What is the IUPAC name of N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine?
The IUPAC name of N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine (CID 170119206) is N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine.
What is the SMILES notation for N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine?
The canonical SMILES for N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine is CC1(c2ccccc2)c2ccccc2-c2ccc(N(c3ccccc3-c3ccccc3-c3ccccc3-c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc21.
What is the InChIKey of N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine?
The InChIKey is HJJXAEHUPQCYGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H44N2/c1-62(44-24-7-3-8-25-44)56-36-18-15-32-51(56)52-41-40-46(42-57(52)62)63(60-39-21-35-55-54-34-17-20-38-59(54)64(61(55)60)45-26-9-4-10-27-45)58-37-19-16-33-53(58)50-31-14-13-30-49(50)48-29-12-11-28-47(48)43-22-5-2-6-23-43/h2-42H,1H3.
What are the key properties of N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine?
N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine has a molecular weight of 817.05 g/mol, XLogP of 16.59, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methyl-9-phenylfluoren-2-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine is sourced from PubChem (CID 170119206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).