9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine

C59H43N — CID 169019931

IUPAC9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3cccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c3)c3ccccc3-c3ccc(-c4ccc5ccccc5c4)cc3)cccc21
InChIInChI=1S/C59H43N/c1-59(2)54-21-9-7-20-53(54)58-55(59)22-12-24-57(58)60(51-18-11-17-48(39-51)42-25-27-43(28-26-42)49-35-31-40-13-3-5-15-46(40)37-49)56-23-10-8-19-52(56)45-33-29-44(30-34-45)50-36-32-41-14-4-6-16-47(41)38-50/h3-39H,1-2H3
InChIKeyACJHUBTWVGAEBU-UHFFFAOYSA-N
MW766.00 g/mol
LogP16.44
Rot. Bonds7

About 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine

9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine (PubChem CID 169019931) has the molecular formula C59H43N and a molecular weight of 766.00 g/mol. Its IUPAC name is 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine
PubChem CID169019931
Molecular FormulaC59H43N
Molecular Weight766.00 g/mol
Exact Mass765.34
IUPAC Name9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3cccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c3)c3ccccc3-c3ccc(-c4ccc5ccccc5c4)cc3)cccc21
InChIInChI=1S/C59H43N/c1-59(2)54-21-9-7-20-53(54)58-55(59)22-12-24-57(58)60(51-18-11-17-48(39-51)42-25-27-43(28-26-42)49-35-31-40-13-3-5-15-46(40)37-49)56-23-10-8-19-52(56)45-33-29-44(30-34-45)50-36-32-41-14-4-6-16-47(41)38-50/h3-39H,1-2H3
InChIKeyACJHUBTWVGAEBU-UHFFFAOYSA-N
XLogP16.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500766.00
LogP ≤ 516.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-N,N-bis[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine
CID 169020071
9,9-dimethyl-N-(3-naphthalen-2-ylphenyl)-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-4-amine
CID 170117408
9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(2-phenylphenyl)phenyl]fluoren-4-amine
CID 169020176
N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)fluoren-4-amine
CID 155181875
9,9-dimethyl-N-naphthalen-2-yl-N-[3-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169019857
9,9-dimethyl-N-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)fluoren-4-amine
CID 169020370
9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-[2-(4-naphthalen-1-ylphenyl)phenyl]fluoren-4-amine
CID 169019982
N-(2,4-dinaphthalen-2-ylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-4-amine
CID 155181697
9,9-dimethyl-N-naphthalen-2-yl-N-[4-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169019813
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-(2-naphthalen-2-yl-4-phenylphenyl)fluoren-2-amine
CID 155181751
N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-N-(3-naphthalen-2-ylphenyl)-3-phenyl-2-(2-phenylphenyl)aniline
CID 168789559
N-(9,9-dimethylfluoren-4-yl)-N-(3-naphthalen-2-ylphenyl)benzo[g]phenanthren-3-amine
CID 167183259

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine?
The IUPAC name of 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine (CID 169019931) is 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine.
What is the SMILES notation for 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine?
The canonical SMILES for 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine is CC1(C)c2ccccc2-c2c(N(c3cccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c3)c3ccccc3-c3ccc(-c4ccc5ccccc5c4)cc3)cccc21.
What is the InChIKey of 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine?
The InChIKey is ACJHUBTWVGAEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H43N/c1-59(2)54-21-9-7-20-53(54)58-55(59)22-12-24-57(58)60(51-18-11-17-48(39-51)42-25-27-43(28-26-42)49-35-31-40-13-3-5-15-46(40)37-49)56-23-10-8-19-52(56)45-33-29-44(30-34-45)50-36-32-41-14-4-6-16-47(41)38-50/h3-39H,1-2H3.
What are the key properties of 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine?
9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine has a molecular weight of 766.00 g/mol, XLogP of 16.44, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[3-(4-naphthalen-2-ylphenyl)phenyl]fluoren-4-amine is sourced from PubChem (CID 169019931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).