N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide

C14H19NO3 — CID 113340576

IUPACN-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide
SMILESC=CCN(CCO)C(=O)COc1ccccc1C
InChIInChI=1S/C14H19NO3/c1-3-8-15(9-10-16)14(17)11-18-13-7-5-4-6-12(13)2/h3-7,16H,1,8-11H2,2H3
InChIKeyYSMNWLKZBZWODX-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.38
Rot. Bonds7

About N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide

N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide (PubChem CID 113340576) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide
PubChem CID113340576
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC NameN-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide
SMILESC=CCN(CCO)C(=O)COc1ccccc1C
InChIInChI=1S/C14H19NO3/c1-3-8-15(9-10-16)14(17)11-18-13-7-5-4-6-12(13)2/h3-7,16H,1,8-11H2,2H3
InChIKeyYSMNWLKZBZWODX-UHFFFAOYSA-N
XLogP1.38
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.38
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

2-(2-cyanophenoxy)-N-(propan-2-yl)acetamide
CID 2565339
Morpholine, 4-((2,4-dimethylphenoxy)acetyl)-
CID 876380
N,N-Diethyl-2-(2-methoxy-4-(2-propen-1-yl)phenoxy)acetamide
CID 67538
Morpholine, 1-((2,5-dimethylphenoxy)acetyl)-
CID 920934
Tolpronine
CID 201768
2-[4-(benzyloxy)phenoxy]-N-ethylacetamide
CID 1257662
(E)-1-morpholin-4-yl-3-(4-propoxyphenyl)prop-2-en-1-one
CID 1569010
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2-methylphenoxy)propanamide
CID 2977623
N-[2-(2-Propylphenoxy)ethyl]acetamide
CID 559346
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 729861
N-ethyl-2-(4-ethylphenoxy)acetamide
CID 3474705
4-[(3-Methylphenoxy)acetyl]morpholine
CID 4478117

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide (CID 113340576) is N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide is C=CCN(CCO)C(=O)COc1ccccc1C.
What is the InChIKey of N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide?
The InChIKey is YSMNWLKZBZWODX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-3-8-15(9-10-16)14(17)11-18-13-7-5-4-6-12(13)2/h3-7,16H,1,8-11H2,2H3.
What are the key properties of N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide?
N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide has a molecular weight of 249.31 g/mol, XLogP of 1.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide is sourced from PubChem (CID 113340576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).