4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline

C25H19FN2 — CID 21131238

IUPAC4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline
SMILESNc1ccc(C2(c3ccc(N)c(F)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C25H19FN2/c26-23-15-17(11-14-24(23)28)25(16-9-12-18(27)13-10-16)21-7-3-1-5-19(21)20-6-2-4-8-22(20)25/h1-15H,27-28H2
InChIKeyUIRUZKNRIXPOJW-UHFFFAOYSA-N
MW366.44 g/mol
LogP5.35
Rot. Bonds2

About 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline

4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline (PubChem CID 21131238) has the molecular formula C25H19FN2 and a molecular weight of 366.44 g/mol. Its IUPAC name is 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline.

Molecular Properties

Compound Name4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline
PubChem CID21131238
Molecular FormulaC25H19FN2
Molecular Weight366.44 g/mol
Exact Mass366.15
IUPAC Name4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline
SMILESNc1ccc(C2(c3ccc(N)c(F)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C25H19FN2/c26-23-15-17(11-14-24(23)28)25(16-9-12-18(27)13-10-16)21-7-3-1-5-19(21)20-6-2-4-8-22(20)25/h1-15H,27-28H2
InChIKeyUIRUZKNRIXPOJW-UHFFFAOYSA-N
XLogP5.35
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.44
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_F(14)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline?
The IUPAC name of 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline (CID 21131238) is 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline.
What is the SMILES notation for 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline?
The canonical SMILES for 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline is Nc1ccc(C2(c3ccc(N)c(F)c3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline?
The InChIKey is UIRUZKNRIXPOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2/c26-23-15-17(11-14-24(23)28)25(16-9-12-18(27)13-10-16)21-7-3-1-5-19(21)20-6-2-4-8-22(20)25/h1-15H,27-28H2.
What are the key properties of 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline?
4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline has a molecular weight of 366.44 g/mol, XLogP of 5.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[9-(4-aminophenyl)fluoren-9-yl]-2-fluoroaniline is sourced from PubChem (CID 21131238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).