9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine

C66H46N2 — CID 170304169

IUPAC9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c3ccccc3-c3cccc4cccc(-c5ccccc5)c34)cccc21
InChIInChI=1S/C66H46N2/c1-66(49-24-7-3-8-25-49)58-33-14-11-30-57(58)65-59(66)34-19-37-62(65)67(61-36-16-13-29-54(61)56-32-18-23-47-22-17-31-52(64(47)56)46-20-5-2-6-21-46)51-41-38-45(39-42-51)48-40-43-55-53-28-12-15-35-60(53)68(63(55)44-48)50-26-9-4-10-27-50/h2-44H,1H3
InChIKeyNJZBPWIWDLQLHY-UHFFFAOYSA-N
MW867.11 g/mol
LogP17.74
Rot. Bonds8

About 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine

9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine (PubChem CID 170304169) has the molecular formula C66H46N2 and a molecular weight of 867.11 g/mol. Its IUPAC name is 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine.

Molecular Properties

Compound Name9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
PubChem CID170304169
Molecular FormulaC66H46N2
Molecular Weight867.11 g/mol
Exact Mass866.37
IUPAC Name9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c3ccccc3-c3cccc4cccc(-c5ccccc5)c34)cccc21
InChIInChI=1S/C66H46N2/c1-66(49-24-7-3-8-25-49)58-33-14-11-30-57(58)65-59(66)34-19-37-62(65)67(61-36-16-13-29-54(61)56-32-18-23-47-22-17-31-52(64(47)56)46-20-5-2-6-21-46)51-41-38-45(39-42-51)48-40-43-55-53-28-12-15-35-60(53)68(63(55)44-48)50-26-9-4-10-27-50/h2-44H,1H3
InChIKeyNJZBPWIWDLQLHY-UHFFFAOYSA-N
XLogP17.74
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500867.11
LogP ≤ 517.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9,9-dimethylfluoren-4-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170304270
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-[2-(8-cyclohexylnaphthalen-1-yl)phenyl]-9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine
CID 170304414
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
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-4-amine
CID 170112243
N-[4-(3-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
CID 167222274
9-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020096
2-(9,9-dimethylfluoren-2-yl)-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170304314
N-[4-(9-methylfluoren-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 129293021
N-[4-[2-(4-benzo[b]carbazol-5-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 134380599
N-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]-N-[4-(9-phenylcarbazol-1-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 170112904

Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine?
The IUPAC name of 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine (CID 170304169) is 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine.
What is the SMILES notation for 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine?
The canonical SMILES for 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine is CC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c3ccccc3-c3cccc4cccc(-c5ccccc5)c34)cccc21.
What is the InChIKey of 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine?
The InChIKey is NJZBPWIWDLQLHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H46N2/c1-66(49-24-7-3-8-25-49)58-33-14-11-30-57(58)65-59(66)34-19-37-62(65)67(61-36-16-13-29-54(61)56-32-18-23-47-22-17-31-52(64(47)56)46-20-5-2-6-21-46)51-41-38-45(39-42-51)48-40-43-55-53-28-12-15-35-60(53)68(63(55)44-48)50-26-9-4-10-27-50/h2-44H,1H3.
What are the key properties of 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine?
9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine has a molecular weight of 867.11 g/mol, XLogP of 17.74, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine is sourced from PubChem (CID 170304169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).