N-(2-ethenylphenyl)pent-4-enamide

C13H15NO — CID 71373130

IUPACN-(2-ethenylphenyl)pent-4-enamide
SMILESC=CCCC(=O)Nc1ccccc1C=C
InChIInChI=1S/C13H15NO/c1-3-5-10-13(15)14-12-9-7-6-8-11(12)4-2/h3-4,6-9H,1-2,5,10H2,(H,14,15)
InChIKeyGWQBMYPNYGGWAQ-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.23
Rot. Bonds5

About N-(2-ethenylphenyl)pent-4-enamide

N-(2-ethenylphenyl)pent-4-enamide (PubChem CID 71373130) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(2-ethenylphenyl)pent-4-enamide.

Molecular Properties

Compound NameN-(2-ethenylphenyl)pent-4-enamide
PubChem CID71373130
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC NameN-(2-ethenylphenyl)pent-4-enamide
SMILESC=CCCC(=O)Nc1ccccc1C=C
InChIInChI=1S/C13H15NO/c1-3-5-10-13(15)14-12-9-7-6-8-11(12)4-2/h3-4,6-9H,1-2,5,10H2,(H,14,15)
InChIKeyGWQBMYPNYGGWAQ-UHFFFAOYSA-N
XLogP3.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.23
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-[2-(ethylaminomethyl)phenyl]pent-4-enamide
CID 62678727
2-[2-(pent-4-enoylamino)phenoxy]acetic acid
CID 55242650
N-but-3-enyl-2-ethenylaniline
CID 134968878
N-(2-ethenylphenyl)-2,2,2-trifluoroacetamide
CID 11127643
3-(2-ethenylanilino)propanoic acid
CID 174297472
N-(2,4-dichlorophenyl)pent-4-enamide
CID 121218276
2-chloro-N-(2-formylphenyl)acetamide
CID 12533349
N-(2-hydroxy-4-methylphenyl)pent-4-enamide
CID 62677203
5-hydroxy-2-(pent-4-enoylamino)benzoic acid
CID 55102905
N-(4-chloro-2-fluorophenyl)pent-4-enamide
CID 155976880
N-[2-[(E)-hex-1-enyl]phenyl]butanamide
CID 173339802
methyl 3-(2-ethenylanilino)propanoate
CID 174296547

Frequently Asked Questions

What is the IUPAC name of N-(2-ethenylphenyl)pent-4-enamide?
The IUPAC name of N-(2-ethenylphenyl)pent-4-enamide (CID 71373130) is N-(2-ethenylphenyl)pent-4-enamide.
What is the SMILES notation for N-(2-ethenylphenyl)pent-4-enamide?
The canonical SMILES for N-(2-ethenylphenyl)pent-4-enamide is C=CCCC(=O)Nc1ccccc1C=C.
What is the InChIKey of N-(2-ethenylphenyl)pent-4-enamide?
The InChIKey is GWQBMYPNYGGWAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-3-5-10-13(15)14-12-9-7-6-8-11(12)4-2/h3-4,6-9H,1-2,5,10H2,(H,14,15).
What are the key properties of N-(2-ethenylphenyl)pent-4-enamide?
N-(2-ethenylphenyl)pent-4-enamide has a molecular weight of 201.27 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethenylphenyl)pent-4-enamide is sourced from PubChem (CID 71373130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).