[2-(4-fluorobenzoyl)phenyl]azanium

C13H11FNO+ — CID 101152012

IUPAC[2-(4-fluorobenzoyl)phenyl]azanium
SMILES[NH3+]c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C13H10FNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2/p+1
InChIKeyFFFXIQFESQNINT-UHFFFAOYSA-O
MW216.24 g/mol
LogP1.93
Rot. Bonds2

About [2-(4-fluorobenzoyl)phenyl]azanium

[2-(4-fluorobenzoyl)phenyl]azanium (PubChem CID 101152012) has the molecular formula C13H11FNO+ and a molecular weight of 216.24 g/mol. Its IUPAC name is [2-(4-fluorobenzoyl)phenyl]azanium.

Molecular Properties

Compound Name[2-(4-fluorobenzoyl)phenyl]azanium
PubChem CID101152012
Molecular FormulaC13H11FNO+
Molecular Weight216.24 g/mol
Exact Mass216.08
IUPAC Name[2-(4-fluorobenzoyl)phenyl]azanium
SMILES[NH3+]c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C13H10FNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2/p+1
InChIKeyFFFXIQFESQNINT-UHFFFAOYSA-O
XLogP1.93
TPSA44.71 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}

Analyze [2-(4-fluorobenzoyl)phenyl]azanium with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-fluorobenzoyl)benzoate
CID 5082940
(4-fluorophenyl)-phenylmethanone
CID 161464622
2-[2-(4-fluorobenzoyl)phenyl]acetic acid
CID 132556862
N',2-bis(4-fluorobenzoyl)benzohydrazide
CID 55554421
(2-benzoyl-4-fluorophenyl)-(4-fluorophenyl)methanone
CID 139633468
(3-chloro-2-fluorophenyl)-(4-fluorophenyl)methanone
CID 64714669
(2,3-dimethylphenyl)-(4-fluorophenyl)methanone
CID 43159951
(4-fluorophenyl)-(2-phenyldiazenylphenyl)methanone
CID 132531231
4-(4-fluorobenzoyl)-2,3-dihydroinden-1-one
CID 13193099
(2-benzylsulfanylphenyl)-(4-fluorophenyl)methanone
CID 151592012
1-(4-fluorobenzoyl)-2-[methyl(sulfino)amino]benzene
CID 167113383
(2,3-dimethoxyphenyl)-(4-fluorophenyl)methanone
CID 105078663

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorobenzoyl)phenyl]azanium?
The IUPAC name of [2-(4-fluorobenzoyl)phenyl]azanium (CID 101152012) is [2-(4-fluorobenzoyl)phenyl]azanium.
What is the SMILES notation for [2-(4-fluorobenzoyl)phenyl]azanium?
The canonical SMILES for [2-(4-fluorobenzoyl)phenyl]azanium is [NH3+]c1ccccc1C(=O)c1ccc(F)cc1.
What is the InChIKey of [2-(4-fluorobenzoyl)phenyl]azanium?
The InChIKey is FFFXIQFESQNINT-UHFFFAOYSA-O. The full InChI is InChI=1S/C13H10FNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2/p+1.
What are the key properties of [2-(4-fluorobenzoyl)phenyl]azanium?
[2-(4-fluorobenzoyl)phenyl]azanium has a molecular weight of 216.24 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorobenzoyl)phenyl]azanium is sourced from PubChem (CID 101152012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).