N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide

C21H16FNO — CID 166628260

IUPACN-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide
SMILESO=C(Nc1ccccc1/C=C/c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C21H16FNO/c22-19-14-11-16(12-15-19)10-13-17-6-4-5-9-20(17)23-21(24)18-7-2-1-3-8-18/h1-15H,(H,23,24)/b13-10+
InChIKeyVWIUALMLNQKMCL-JLHYYAGUSA-N
MW317.36 g/mol
LogP5.25
Rot. Bonds4

About N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide

N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide (PubChem CID 166628260) has the molecular formula C21H16FNO and a molecular weight of 317.36 g/mol. Its IUPAC name is N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide
PubChem CID166628260
Molecular FormulaC21H16FNO
Molecular Weight317.36 g/mol
Exact Mass317.12
IUPAC NameN-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide
SMILESO=C(Nc1ccccc1/C=C/c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C21H16FNO/c22-19-14-11-16(12-15-19)10-13-17-6-4-5-9-20(17)23-21(24)18-7-2-1-3-8-18/h1-15H,(H,23,24)/b13-10+
InChIKeyVWIUALMLNQKMCL-JLHYYAGUSA-N
XLogP5.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.36
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide 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

4-[2-[2-[(2,6-dichlorobenzoyl)amino]phenyl]ethenyl]benzoic acid
CID 174535080
4-fluoro-N-(2-iodophenyl)benzamide
CID 687036
N-[4-[[3-(4-fluorophenyl)prop-2-enoylamino]carbamoyl]phenyl]benzamide
CID 3299354
4-benzoyl-N-(4-fluorophenyl)benzamide
CID 2315903
N-[2-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-1H-pyrazole-5-carboxamide
CID 166629984
N-[(4-fluorophenyl)methylideneamino]benzamide
CID 724426
4-tert-butyl-N-[2-[(4-fluorobenzoyl)amino]phenyl]benzamide
CID 10500600
3-(4-benzamido-3-fluorophenyl)prop-2-enoic acid
CID 76907482
4-formyl-N-[2-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]benzamide
CID 86628199
N-(2,3-difluorophenyl)benzamide
CID 139202270
N-[2-[(E)-2-phenylethenyl]phenyl]ethanethioamide
CID 134891293
N-(2-aminophenyl)-4-methylbenzamide;(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide
CID 143788196

Frequently Asked Questions

What is the IUPAC name of N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide?
The IUPAC name of N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide (CID 166628260) is N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide.
What is the SMILES notation for N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide?
The canonical SMILES for N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide is O=C(Nc1ccccc1/C=C/c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide?
The InChIKey is VWIUALMLNQKMCL-JLHYYAGUSA-N. The full InChI is InChI=1S/C21H16FNO/c22-19-14-11-16(12-15-19)10-13-17-6-4-5-9-20(17)23-21(24)18-7-2-1-3-8-18/h1-15H,(H,23,24)/b13-10+.
What are the key properties of N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide?
N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide has a molecular weight of 317.36 g/mol, XLogP of 5.25, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(E)-2-(4-fluorophenyl)ethenyl]phenyl]benzamide is sourced from PubChem (CID 166628260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).