N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

C61H43N — CID 163478747

IUPACN,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3cccc(-c5ccccc5)c3)c3cc(-c5ccccc5)cc(-c5ccccc5)c3-4)cc2)cc1
InChIInChI=1S/C61H43N/c1-7-20-44(21-8-1)47-34-36-54(37-35-47)62(53-32-17-6-18-33-53)55-38-39-56-58(43-55)61(51-29-15-5-16-30-51,52-31-19-28-49(40-52)45-22-9-2-10-23-45)59-42-50(46-24-11-3-12-25-46)41-57(60(56)59)48-26-13-4-14-27-48/h1-43H
InChIKeyCCTTUUURRYNNBM-UHFFFAOYSA-N
MW790.02 g/mol
LogP16.19
Rot. Bonds9

About N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 163478747) has the molecular formula C61H43N and a molecular weight of 790.02 g/mol. Its IUPAC name is N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID163478747
Molecular FormulaC61H43N
Molecular Weight790.02 g/mol
Exact Mass789.34
IUPAC NameN,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3cccc(-c5ccccc5)c3)c3cc(-c5ccccc5)cc(-c5ccccc5)c3-4)cc2)cc1
InChIInChI=1S/C61H43N/c1-7-20-44(21-8-1)47-34-36-54(37-35-47)62(53-32-17-6-18-33-53)55-38-39-56-58(43-55)61(51-29-15-5-16-30-51,52-31-19-28-49(40-52)45-22-9-2-10-23-45)59-42-50(46-24-11-3-12-25-46)41-57(60(56)59)48-26-13-4-14-27-48/h1-43H
InChIKeyCCTTUUURRYNNBM-UHFFFAOYSA-N
XLogP16.19
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms62
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500790.02
LogP ≤ 516.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (CID 163478747) is N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3cccc(-c5ccccc5)c3)c3cc(-c5ccccc5)cc(-c5ccccc5)c3-4)cc2)cc1.
What is the InChIKey of N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is CCTTUUURRYNNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H43N/c1-7-20-44(21-8-1)47-34-36-54(37-35-47)62(53-32-17-6-18-33-53)55-38-39-56-58(43-55)61(51-29-15-5-16-30-51,52-31-19-28-49(40-52)45-22-9-2-10-23-45)59-42-50(46-24-11-3-12-25-46)41-57(60(56)59)48-26-13-4-14-27-48/h1-43H.
What are the key properties of N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 790.02 g/mol, XLogP of 16.19, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,7,9-tetraphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 163478747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).