N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide

C15H18N2O3 — CID 113158573

IUPACN-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CC(=O)Nc1ccc(C(C)=O)cc1)C(C)=O
InChIInChI=1S/C15H18N2O3/c1-4-9-17(12(3)19)10-15(20)16-14-7-5-13(6-8-14)11(2)18/h4-8H,1,9-10H2,2-3H3,(H,16,20)
InChIKeyVYAKPUFUVWIEPW-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.86
Rot. Bonds6

About N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide

N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide (PubChem CID 113158573) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide
PubChem CID113158573
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CC(=O)Nc1ccc(C(C)=O)cc1)C(C)=O
InChIInChI=1S/C15H18N2O3/c1-4-9-17(12(3)19)10-15(20)16-14-7-5-13(6-8-14)11(2)18/h4-8H,1,9-10H2,2-3H3,(H,16,20)
InChIKeyVYAKPUFUVWIEPW-UHFFFAOYSA-N
XLogP1.86
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamidophenyl)-2-[acetyl(prop-2-enyl)amino]acetamide
CID 84570055
2-[acetyl(prop-2-enyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide
CID 113158570
2-[acetyl(3-methylbutyl)amino]-N-(4-acetylphenyl)acetamide
CID 113166595
N-(4-acetylphenyl)-2-[acetyl(3-phenylpropyl)amino]acetamide
CID 113165901
4-acetyl-N,N-bis(prop-2-enyl)benzamide
CID 67089080
2-[(4-acetylphenyl)sulfonyl-prop-2-enylamino]-N-(4-bromophenyl)acetamide
CID 17433895
2-[acetyl(prop-2-enyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 84566729
2-[(4-acetylphenyl)sulfonyl-prop-2-enylamino]-N-phenylacetamide
CID 17443852
2-[acetyl(prop-2-enyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 84563712
2-[acetyl(prop-2-enyl)amino]-N-(2-methoxyphenyl)acetamide
CID 84571235
2-[[2-(4-acetylanilino)-2-oxoethyl]-methylamino]acetic acid
CID 43442578
1-[4-(prop-2-enylamino)phenyl]ethanone
CID 21163521

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide (CID 113158573) is N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide is C=CCN(CC(=O)Nc1ccc(C(C)=O)cc1)C(C)=O.
What is the InChIKey of N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide?
The InChIKey is VYAKPUFUVWIEPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-4-9-17(12(3)19)10-15(20)16-14-7-5-13(6-8-14)11(2)18/h4-8H,1,9-10H2,2-3H3,(H,16,20).
What are the key properties of N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide?
N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide has a molecular weight of 274.32 g/mol, XLogP of 1.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[acetyl(prop-2-enyl)amino]acetamide is sourced from PubChem (CID 113158573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).