9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine

C43H31N — CID 155297478

IUPAC9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine
SMILESc1ccc(-c2ccc(C3(c4ccccc4)c4ccccc4-c4c(Nc5ccccc5-c5ccccc5)cccc43)cc2)cc1
InChIInChI=1S/C43H31N/c1-4-15-31(16-5-1)32-27-29-35(30-28-32)43(34-19-8-3-9-20-34)38-23-12-10-22-37(38)42-39(43)24-14-26-41(42)44-40-25-13-11-21-36(40)33-17-6-2-7-18-33/h1-30,44H
InChIKeyVJXYAFBXIIOZJF-UHFFFAOYSA-N
MW561.73 g/mol
LogP11.13
Rot. Bonds6

About 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine

9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine (PubChem CID 155297478) has the molecular formula C43H31N and a molecular weight of 561.73 g/mol. Its IUPAC name is 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine.

Molecular Properties

Compound Name9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine
PubChem CID155297478
Molecular FormulaC43H31N
Molecular Weight561.73 g/mol
Exact Mass561.25
IUPAC Name9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine
SMILESc1ccc(-c2ccc(C3(c4ccccc4)c4ccccc4-c4c(Nc5ccccc5-c5ccccc5)cccc43)cc2)cc1
InChIInChI=1S/C43H31N/c1-4-15-31(16-5-1)32-27-29-35(30-28-32)43(34-19-8-3-9-20-34)38-23-12-10-22-37(38)42-39(43)24-14-26-41(42)44-40-25-13-11-21-36(40)33-17-6-2-7-18-33/h1-30,44H
InChIKeyVJXYAFBXIIOZJF-UHFFFAOYSA-N
XLogP11.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms44
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.73
LogP ≤ 511.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine?
The IUPAC name of 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine (CID 155297478) is 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine.
What is the SMILES notation for 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine?
The canonical SMILES for 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine is c1ccc(-c2ccc(C3(c4ccccc4)c4ccccc4-c4c(Nc5ccccc5-c5ccccc5)cccc43)cc2)cc1.
What is the InChIKey of 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine?
The InChIKey is VJXYAFBXIIOZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H31N/c1-4-15-31(16-5-1)32-27-29-35(30-28-32)43(34-19-8-3-9-20-34)38-23-12-10-22-37(38)42-39(43)24-14-26-41(42)44-40-25-13-11-21-36(40)33-17-6-2-7-18-33/h1-30,44H.
What are the key properties of 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine?
9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine has a molecular weight of 561.73 g/mol, XLogP of 11.13, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-N-(2-phenylphenyl)-9-(4-phenylphenyl)fluoren-4-amine is sourced from PubChem (CID 155297478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).