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

C15H20N2O3 — CID 115631892

IUPACN-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CCO)CC(=O)Nc1ccccc1C(C)=O
InChIInChI=1S/C15H20N2O3/c1-3-8-17(9-10-18)11-15(20)16-14-7-5-4-6-13(14)12(2)19/h3-7,18H,1,8-11H2,2H3,(H,16,20)
InChIKeyOPNCEVKEQBSKNW-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.31
Rot. Bonds8

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

N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide (PubChem CID 115631892) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
PubChem CID115631892
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CCO)CC(=O)Nc1ccccc1C(C)=O
InChIInChI=1S/C15H20N2O3/c1-3-8-17(9-10-18)11-15(20)16-14-7-5-4-6-13(14)12(2)19/h3-7,18H,1,8-11H2,2H3,(H,16,20)
InChIKeyOPNCEVKEQBSKNW-UHFFFAOYSA-N
XLogP1.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-[ethyl(2-hydroxyethyl)amino]acetyl]amino]benzamide
CID 60685820
N'-acetyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetohydrazide
CID 115747968
N-(2-fluorophenyl)-2-[2-phenylethyl(prop-2-enyl)amino]acetamide
CID 86860874
3-[[2-(2-fluoroanilino)-2-oxoethyl]-prop-2-enylamino]propanoic acid
CID 82326624
3-[[2-(2-methoxyanilino)-2-oxoethyl]-prop-2-enylamino]propanoic acid
CID 82326650
N-(3-ethylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
CID 111423165
N-(4-bromo-2-chlorophenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
CID 111423143
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
CID 111423108
N-(2-acetylphenyl)-2-[methyl(3-methylbutyl)amino]acetamide
CID 47287860
N-(2-acetamidoethyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
CID 113237459
N-(2-aminophenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
CID 61242990
N-(2-acetylphenyl)-2-[cyclopropyl(methyl)amino]acetamide
CID 30891872

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The IUPAC name of N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide (CID 115631892) is N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The canonical SMILES for N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide is C=CCN(CCO)CC(=O)Nc1ccccc1C(C)=O.
What is the InChIKey of N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The InChIKey is OPNCEVKEQBSKNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-3-8-17(9-10-18)11-15(20)16-14-7-5-4-6-13(14)12(2)19/h3-7,18H,1,8-11H2,2H3,(H,16,20).
What are the key properties of N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide has a molecular weight of 276.34 g/mol, XLogP of 1.31, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide is sourced from PubChem (CID 115631892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).