9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine

C70H57N — CID 145345952

IUPAC9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3-c3ccc4ccccc4c3)c3ccc(-c4ccc(-c5ccc(C67CC8CC9CC(C6)C9(C8)C7)cc5)cc4)cc3-c3cccc4ccccc34)cc21
InChIInChI=1S/C70H57N/c1-68(2)64-20-9-7-18-61(64)62-34-33-57(40-65(62)68)71(66-21-10-8-17-59(66)53-27-26-46-12-3-4-14-51(46)37-53)67-35-30-52(38-63(67)60-19-11-15-50-13-5-6-16-58(50)60)49-24-22-47(23-25-49)48-28-31-54(32-29-48)69-41-45-36-55-39-56(43-69)70(55,42-45)44-69/h3-35,37-38,40,45,55-56H,36,39,41-44H2,1-2H3
InChIKeyXLQYENYZMWYMIU-UHFFFAOYSA-N
MW912.23 g/mol
LogP18.90
Rot. Bonds8

About 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine

9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine (PubChem CID 145345952) has the molecular formula C70H57N and a molecular weight of 912.23 g/mol. Its IUPAC name is 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine
PubChem CID145345952
Molecular FormulaC70H57N
Molecular Weight912.23 g/mol
Exact Mass911.45
IUPAC Name9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3-c3ccc4ccccc4c3)c3ccc(-c4ccc(-c5ccc(C67CC8CC9CC(C6)C9(C8)C7)cc5)cc4)cc3-c3cccc4ccccc34)cc21
InChIInChI=1S/C70H57N/c1-68(2)64-20-9-7-18-61(64)62-34-33-57(40-65(62)68)71(66-21-10-8-17-59(66)53-27-26-46-12-3-4-14-51(46)37-53)67-35-30-52(38-63(67)60-19-11-15-50-13-5-6-16-58(50)60)49-24-22-47(23-25-49)48-28-31-54(32-29-48)69-41-45-36-55-39-56(43-69)70(55,42-45)44-69/h3-35,37-38,40,45,55-56H,36,39,41-44H2,1-2H3
InChIKeyXLQYENYZMWYMIU-UHFFFAOYSA-N
XLogP18.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500912.23
LogP ≤ 518.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine with MolForge

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Related Compounds

N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine
CID 137414910
N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-1-ylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 161446051
N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)fluoren-2-amine
CID 137414909
N-[4-[4-(1-adamantyl)phenyl]-2-phenylphenyl]-9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)fluoren-2-amine
CID 130203835
N-[4-[4-[4-(1-adamantyl)phenyl]phenyl]-2-naphthalen-1-ylphenyl]-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-2-amine
CID 130204057
N-[4-[4-[4-(1-adamantyl)phenyl]phenyl]-2-naphthalen-1-ylphenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 130203868
N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 159446376
N-[4-[4-(1-adamantyl)phenyl]-2-naphthalen-2-ylphenyl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine
CID 130203887
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-methylphenyl)-2-naphthalen-1-ylphenyl]fluoren-2-amine
CID 146579363
9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(2-naphthalen-2-yl-4-phenylphenyl)fluoren-2-amine
CID 164774109
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[2-phenyl-4-[4-[4-(3-tetracyclo[5.2.1.03,8.05,8]decanyl)phenyl]phenyl]phenyl]fluoren-2-amine
CID 145345956
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)fluoren-2-amine
CID 121323170

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine (CID 145345952) is 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccccc3-c3ccc4ccccc4c3)c3ccc(-c4ccc(-c5ccc(C67CC8CC9CC(C6)C9(C8)C7)cc5)cc4)cc3-c3cccc4ccccc34)cc21.
What is the InChIKey of 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine?
The InChIKey is XLQYENYZMWYMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H57N/c1-68(2)64-20-9-7-18-61(64)62-34-33-57(40-65(62)68)71(66-21-10-8-17-59(66)53-27-26-46-12-3-4-14-51(46)37-53)67-35-30-52(38-63(67)60-19-11-15-50-13-5-6-16-58(50)60)49-24-22-47(23-25-49)48-28-31-54(32-29-48)69-41-45-36-55-39-56(43-69)70(55,42-45)44-69/h3-35,37-38,40,45,55-56H,36,39,41-44H2,1-2H3.
What are the key properties of 9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine?
9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine has a molecular weight of 912.23 g/mol, XLogP of 18.90, 8 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-naphthalen-2-ylphenyl)-N-[2-naphthalen-1-yl-4-[4-[4-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)phenyl]phenyl]phenyl]fluoren-2-amine is sourced from PubChem (CID 145345952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).