N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide

C11H14N2O4 — CID 108502057

IUPACN'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide
SMILESCN(CCO)C(=O)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C11H14N2O4/c1-13(6-7-14)11(17)10(16)12-8-2-4-9(15)5-3-8/h2-5,14-15H,6-7H2,1H3,(H,12,16)
InChIKeyXDQARKSZGYEYGY-UHFFFAOYSA-N
MW238.24 g/mol
LogP-0.22
Rot. Bonds3

About N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide

N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide (PubChem CID 108502057) has the molecular formula C11H14N2O4 and a molecular weight of 238.24 g/mol. Its IUPAC name is N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide.

Molecular Properties

Compound NameN'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide
PubChem CID108502057
Molecular FormulaC11H14N2O4
Molecular Weight238.24 g/mol
Exact Mass238.10
IUPAC NameN'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide
SMILESCN(CCO)C(=O)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C11H14N2O4/c1-13(6-7-14)11(17)10(16)12-8-2-4-9(15)5-3-8/h2-5,14-15H,6-7H2,1H3,(H,12,16)
InChIKeyXDQARKSZGYEYGY-UHFFFAOYSA-N
XLogP-0.22
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-ethoxyphenyl)-N'-(2-hydroxyethyl)-N'-methyloxamide
CID 108514458
N-(4-amino-3-chlorophenyl)-N'-(2-hydroxyethyl)-N'-methyloxamide
CID 108516095
N-(3H-benzimidazol-5-yl)-N'-(2-hydroxyethyl)-N'-methyloxamide
CID 108526708
N'-(2-hydroxyethyl)-N-(1H-indazol-6-yl)-N'-methyloxamide
CID 108526719
N-(4-acetylphenyl)-N'-butyl-N'-methyloxamide
CID 47334598
3-[4-(dimethylamino)phenyl]-1-(2-hydroxyethyl)-1-methylurea
CID 108894808
N'-butyl-N'-methyl-N-[4-(trifluoromethyl)phenyl]oxamide
CID 108528580
N'-(2-hydroxyethyl)-N'-methyl-N-(2-propan-2-ylphenyl)oxamide
CID 108500546
N-(2-hydroxyethyl)-2-(4-hydroxyphenyl)-N-methylacetamide
CID 60681963
N-[4-(diethylamino)phenyl]-N'-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108525164
2-hydrazinyl-N-(2-hydroxyethyl)-N-methyl-2-oxoacetamide
CID 60961852
N'-butyl-N'-methyl-N-(4-sulfamoylphenyl)oxamide
CID 108508773

Frequently Asked Questions

What is the IUPAC name of N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide?
The IUPAC name of N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide (CID 108502057) is N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide.
What is the SMILES notation for N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide?
The canonical SMILES for N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide is CN(CCO)C(=O)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide?
The InChIKey is XDQARKSZGYEYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4/c1-13(6-7-14)11(17)10(16)12-8-2-4-9(15)5-3-8/h2-5,14-15H,6-7H2,1H3,(H,12,16).
What are the key properties of N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide?
N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide has a molecular weight of 238.24 g/mol, XLogP of -0.22, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-hydroxyethyl)-N-(4-hydroxyphenyl)-N'-methyloxamide is sourced from PubChem (CID 108502057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).