N-[1-(4-acetylphenyl)ethenyl]acetamide

C12H13NO2 — CID 24873963

IUPACN-[1-(4-acetylphenyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1ccc(C(C)=O)cc1
InChIInChI=1S/C12H13NO2/c1-8(13-10(3)15)11-4-6-12(7-5-11)9(2)14/h4-7H,1H2,2-3H3,(H,13,15)
InChIKeyARMMJBKWFPLMGA-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.00
Rot. Bonds3

About N-[1-(4-acetylphenyl)ethenyl]acetamide

N-[1-(4-acetylphenyl)ethenyl]acetamide (PubChem CID 24873963) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is N-[1-(4-acetylphenyl)ethenyl]acetamide.

Molecular Properties

Compound NameN-[1-(4-acetylphenyl)ethenyl]acetamide
PubChem CID24873963
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC NameN-[1-(4-acetylphenyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1ccc(C(C)=O)cc1
InChIInChI=1S/C12H13NO2/c1-8(13-10(3)15)11-4-6-12(7-5-11)9(2)14/h4-7H,1H2,2-3H3,(H,13,15)
InChIKeyARMMJBKWFPLMGA-UHFFFAOYSA-N
XLogP2.00
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-acetylphenyl)ethenyl]acetamide?
The IUPAC name of N-[1-(4-acetylphenyl)ethenyl]acetamide (CID 24873963) is N-[1-(4-acetylphenyl)ethenyl]acetamide.
What is the SMILES notation for N-[1-(4-acetylphenyl)ethenyl]acetamide?
The canonical SMILES for N-[1-(4-acetylphenyl)ethenyl]acetamide is C=C(NC(C)=O)c1ccc(C(C)=O)cc1.
What is the InChIKey of N-[1-(4-acetylphenyl)ethenyl]acetamide?
The InChIKey is ARMMJBKWFPLMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-8(13-10(3)15)11-4-6-12(7-5-11)9(2)14/h4-7H,1H2,2-3H3,(H,13,15).
What are the key properties of N-[1-(4-acetylphenyl)ethenyl]acetamide?
N-[1-(4-acetylphenyl)ethenyl]acetamide has a molecular weight of 203.24 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-acetylphenyl)ethenyl]acetamide is sourced from PubChem (CID 24873963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).