2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide

C13H18N2O4 — CID 107713094

IUPAC2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1CCO
InChIInChI=1S/C13H18N2O4/c1-9(12(17)15-13(18)14-2)19-11-6-4-3-5-10(11)7-8-16/h3-6,9,16H,7-8H2,1-2H3,(H2,14,15,17,18)
InChIKeyOEPYIZCHILQMBZ-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.44
Rot. Bonds5

About 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide

2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide (PubChem CID 107713094) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
PubChem CID107713094
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1CCO
InChIInChI=1S/C13H18N2O4/c1-9(12(17)15-13(18)14-2)19-11-6-4-3-5-10(11)7-8-16/h3-6,9,16H,7-8H2,1-2H3,(H2,14,15,17,18)
InChIKeyOEPYIZCHILQMBZ-UHFFFAOYSA-N
XLogP0.44
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43115833
N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide
CID 60625654
2-[4-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 107709553
(2R)-N-(methylcarbamoyl)-2-(2-phenylphenoxy)propanamide
CID 7986963
(2R)-2-(2-chlorophenoxy)-N-(methylcarbamoyl)propanamide
CID 7815932
2-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43084667
N-cyclopentyl-2-[2-(2-hydroxyethyl)phenoxy]propanamide
CID 107713127
2-[2-(1-aminopropyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43116458
(2S)-2-(2-ethylphenoxy)-N-methylpropanamide
CID 28577058
[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-(2-methoxyphenyl)propanoate
CID 7871072
[1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-(2-methoxyphenyl)propanoate
CID 42971001
2-[4-fluoro-2-(methylaminomethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 107695387

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide (CID 107713094) is 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)Oc1ccccc1CCO.
What is the InChIKey of 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide?
The InChIKey is OEPYIZCHILQMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-9(12(17)15-13(18)14-2)19-11-6-4-3-5-10(11)7-8-16/h3-6,9,16H,7-8H2,1-2H3,(H2,14,15,17,18).
What are the key properties of 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide?
2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide has a molecular weight of 266.30 g/mol, XLogP of 0.44, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 107713094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).