9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine

C86H58N2 — CID 137392091

IUPAC9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
SMILESCC1(c2cccc(-c3ccc(-c4cccc5ccccc45)c4c(-c5cccc6ccccc56)cccc34)c2)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21
InChIInChI=1S/C86H58N2/c1-86(64-27-16-26-63(54-64)71-51-52-79(73-35-18-25-61-23-9-11-31-70(61)73)85-77(71)36-19-37-78(85)72-34-17-24-60-22-8-10-30-69(60)72)81-38-14-12-32-74(81)75-50-49-68(56-82(75)86)87(66-45-40-58(41-46-66)57-20-4-2-5-21-57)67-47-42-59(43-48-67)62-44-53-84-80(55-62)76-33-13-15-39-83(76)88(84)65-28-6-3-7-29-65/h2-56H,1H3
InChIKeyLENDPLVAGGMZOT-UHFFFAOYSA-N
MW1119.42 g/mol
LogP23.38
Rot. Bonds10

About 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine

9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 137392091) has the molecular formula C86H58N2 and a molecular weight of 1119.42 g/mol. Its IUPAC name is 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID137392091
Molecular FormulaC86H58N2
Molecular Weight1119.42 g/mol
Exact Mass1118.46
IUPAC Name9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
SMILESCC1(c2cccc(-c3ccc(-c4cccc5ccccc45)c4c(-c5cccc6ccccc56)cccc34)c2)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21
InChIInChI=1S/C86H58N2/c1-86(64-27-16-26-63(54-64)71-51-52-79(73-35-18-25-61-23-9-11-31-70(61)73)85-77(71)36-19-37-78(85)72-34-17-24-60-22-8-10-30-69(60)72)81-38-14-12-32-74(81)75-50-49-68(56-82(75)86)87(66-45-40-58(41-46-66)57-20-4-2-5-21-57)67-47-42-59(43-48-67)62-44-53-84-80(55-62)76-33-13-15-39-83(76)88(84)65-28-6-3-7-29-65/h2-56H,1H3
InChIKeyLENDPLVAGGMZOT-UHFFFAOYSA-N
XLogP23.38
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001119.42
LogP ≤ 523.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 137392093
N-[4-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)-5-(3,5-dinaphthalen-1-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-[4-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)-5-(3,5-diphenylphenyl)phenyl]phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-[4-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)-5-naphthalen-1-ylphenyl]phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-[4-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)-5-phenylphenyl]phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 160515695
3-(9-methylfluoren-9-yl)-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 129293023
N-[4-(9-methylfluoren-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 129293021
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-(9-phenylcarbazol-3-yl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]fluoren-2-amine
CID 89212856
9,9-diethyl-N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 147008099
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 89212871
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 90393592
9-methyl-9-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170304175
9,9-dimethyl-N-naphthalen-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 162198244
9,9-diphenyl-N-[4-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 89426449
9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 67964234

Frequently Asked Questions

What is the IUPAC name of 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine (CID 137392091) is 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine is CC1(c2cccc(-c3ccc(-c4cccc5ccccc45)c4c(-c5cccc6ccccc56)cccc34)c2)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21.
What is the InChIKey of 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is LENDPLVAGGMZOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C86H58N2/c1-86(64-27-16-26-63(54-64)71-51-52-79(73-35-18-25-61-23-9-11-31-70(61)73)85-77(71)36-19-37-78(85)72-34-17-24-60-22-8-10-30-69(60)72)81-38-14-12-32-74(81)75-50-49-68(56-82(75)86)87(66-45-40-58(41-46-66)57-20-4-2-5-21-57)67-47-42-59(43-48-67)62-44-53-84-80(55-62)76-33-13-15-39-83(76)88(84)65-28-6-3-7-29-65/h2-56H,1H3.
What are the key properties of 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine?
9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 1119.42 g/mol, XLogP of 23.38, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(4,5-dinaphthalen-1-ylnaphthalen-1-yl)phenyl]-9-methyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 137392091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).