N-(4-prop-2-enylphenyl)benzamide

C16H15NO — CID 67934091

IUPACN-(4-prop-2-enylphenyl)benzamide
SMILESC=CCc1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C16H15NO/c1-2-6-13-9-11-15(12-10-13)17-16(18)14-7-4-3-5-8-14/h2-5,7-12H,1,6H2,(H,17,18)
InChIKeyUQVTZFLPDMSEGL-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.67
Rot. Bonds4

About N-(4-prop-2-enylphenyl)benzamide

N-(4-prop-2-enylphenyl)benzamide (PubChem CID 67934091) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(4-prop-2-enylphenyl)benzamide.

Molecular Properties

Compound NameN-(4-prop-2-enylphenyl)benzamide
PubChem CID67934091
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC NameN-(4-prop-2-enylphenyl)benzamide
SMILESC=CCc1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C16H15NO/c1-2-6-13-9-11-15(12-10-13)17-16(18)14-7-4-3-5-8-14/h2-5,7-12H,1,6H2,(H,17,18)
InChIKeyUQVTZFLPDMSEGL-UHFFFAOYSA-N
XLogP3.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(sulfanylmethyl)phenyl]benzamide
CID 130322927
N-(4-ethylphenyl)benzamide
CID 774063
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
(4-benzamidophenyl)carbamic acid
CID 18543096
4-[[bis(prop-2-enyl)amino]methyl]-N-phenylbenzamide
CID 78821935
N,N'-bis(4-benzamidophenyl)hexanediamide
CID 17235924
N-[4-(2-benzoylhydrazinyl)phenyl]benzamide
CID 23454945
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
4-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]benzamide
CID 55540187
molecular hydrogen;N-phenylbenzamide
CID 145238042
N-[4-[(2-methylhydrazinyl)methyl]phenyl]benzamide;hydrobromide
CID 161255145
N-[4-(2-amino-3-hydroxypropyl)phenyl]benzamide
CID 22634902

Frequently Asked Questions

What is the IUPAC name of N-(4-prop-2-enylphenyl)benzamide?
The IUPAC name of N-(4-prop-2-enylphenyl)benzamide (CID 67934091) is N-(4-prop-2-enylphenyl)benzamide.
What is the SMILES notation for N-(4-prop-2-enylphenyl)benzamide?
The canonical SMILES for N-(4-prop-2-enylphenyl)benzamide is C=CCc1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-prop-2-enylphenyl)benzamide?
The InChIKey is UQVTZFLPDMSEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-6-13-9-11-15(12-10-13)17-16(18)14-7-4-3-5-8-14/h2-5,7-12H,1,6H2,(H,17,18).
What are the key properties of N-(4-prop-2-enylphenyl)benzamide?
N-(4-prop-2-enylphenyl)benzamide has a molecular weight of 237.30 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-prop-2-enylphenyl)benzamide is sourced from PubChem (CID 67934091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).