(4-aminophenyl)-(4-fluorophenyl)methanone

C13H10FNO — CID 577826

IUPAC(4-aminophenyl)-(4-fluorophenyl)methanone
SMILESNc1ccc(C(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C13H10FNO/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H,15H2
InChIKeyJHRKKHFDXTWUJO-UHFFFAOYSA-N
MW215.23 g/mol
LogP2.64
Rot. Bonds2

About (4-aminophenyl)-(4-fluorophenyl)methanone

(4-aminophenyl)-(4-fluorophenyl)methanone (PubChem CID 577826) has the molecular formula C13H10FNO and a molecular weight of 215.23 g/mol. Its IUPAC name is (4-aminophenyl)-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name(4-aminophenyl)-(4-fluorophenyl)methanone
PubChem CID577826
Molecular FormulaC13H10FNO
Molecular Weight215.23 g/mol
Exact Mass215.07
IUPAC Name(4-aminophenyl)-(4-fluorophenyl)methanone
SMILESNc1ccc(C(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C13H10FNO/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H,15H2
InChIKeyJHRKKHFDXTWUJO-UHFFFAOYSA-N
XLogP2.64
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze (4-aminophenyl)-(4-fluorophenyl)methanone 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-aminophenyl)-(4-fluorophenyl)methanone?
The IUPAC name of (4-aminophenyl)-(4-fluorophenyl)methanone (CID 577826) is (4-aminophenyl)-(4-fluorophenyl)methanone.
What is the SMILES notation for (4-aminophenyl)-(4-fluorophenyl)methanone?
The canonical SMILES for (4-aminophenyl)-(4-fluorophenyl)methanone is Nc1ccc(C(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of (4-aminophenyl)-(4-fluorophenyl)methanone?
The InChIKey is JHRKKHFDXTWUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H,15H2.
What are the key properties of (4-aminophenyl)-(4-fluorophenyl)methanone?
(4-aminophenyl)-(4-fluorophenyl)methanone has a molecular weight of 215.23 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-(4-fluorophenyl)methanone is sourced from PubChem (CID 577826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).