N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide

C23H21NO — CID 72696812

IUPACN-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide
SMILESCCc1ccc(NC(=O)c2ccccc2/C=C/c2ccccc2)cc1
InChIInChI=1S/C23H21NO/c1-2-18-13-16-21(17-14-18)24-23(25)22-11-7-6-10-20(22)15-12-19-8-4-3-5-9-19/h3-17H,2H2,1H3,(H,24,25)/b15-12+
InChIKeyTZJMFLBOJNDOHG-NTCAYCPXSA-N
MW327.43 g/mol
LogP5.67
Rot. Bonds5

About N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide

N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide (PubChem CID 72696812) has the molecular formula C23H21NO and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide
PubChem CID72696812
Molecular FormulaC23H21NO
Molecular Weight327.43 g/mol
Exact Mass327.16
IUPAC NameN-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide
SMILESCCc1ccc(NC(=O)c2ccccc2/C=C/c2ccccc2)cc1
InChIInChI=1S/C23H21NO/c1-2-18-13-16-21(17-14-18)24-23(25)22-11-7-6-10-20(22)15-12-19-8-4-3-5-9-19/h3-17H,2H2,1H3,(H,24,25)/b15-12+
InChIKeyTZJMFLBOJNDOHG-NTCAYCPXSA-N
XLogP5.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.43
LogP ≤ 55.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(4-ethylphenyl)benzamide
CID 774063
2-[[4-[(E)-2-phenylethenyl]phenyl]carbamoyl]benzoic acid
CID 680540
N-[4-(2-phenylethenyl)phenyl]naphthalene-1-carboxamide
CID 23853473
N-(4-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 9164162
(E)-N-(4-ethylphenyl)-2,3-diphenylprop-2-enamide
CID 6534390
N-(4-ethylphenyl)-2-ethylsulfonylbenzamide
CID 16604948
2-(carbamothioylamino)-N-(4-ethylphenyl)benzamide
CID 169357769
2-[(2-bromobenzoyl)amino]-N-(4-ethylphenyl)benzamide
CID 1313742
N-[2-(4-ethylphenyl)ethyl]-N'-[4-[(E)-2-phenylethenyl]phenyl]pentanediamide
CID 130369826
N-(4-ethylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
CID 100771775
N-(4-ethylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 17476623
butyl (E)-3-[2-(phenylcarbamoyl)phenyl]prop-2-enoate
CID 135014575

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide?
The IUPAC name of N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide (CID 72696812) is N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide?
The canonical SMILES for N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide is CCc1ccc(NC(=O)c2ccccc2/C=C/c2ccccc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide?
The InChIKey is TZJMFLBOJNDOHG-NTCAYCPXSA-N. The full InChI is InChI=1S/C23H21NO/c1-2-18-13-16-21(17-14-18)24-23(25)22-11-7-6-10-20(22)15-12-19-8-4-3-5-9-19/h3-17H,2H2,1H3,(H,24,25)/b15-12+.
What are the key properties of N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide?
N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide has a molecular weight of 327.43 g/mol, XLogP of 5.67, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-[(E)-2-phenylethenyl]benzamide is sourced from PubChem (CID 72696812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).