N-(4-hydroxyphenyl)-2-methoxyacetamide

C9H11NO3 — CID 836717

IUPACN-(4-hydroxyphenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C9H11NO3/c1-13-6-9(12)10-7-2-4-8(11)5-3-7/h2-5,11H,6H2,1H3,(H,10,12)
InChIKeyNSZUGQROUUTGGI-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.98
Rot. Bonds3

About N-(4-hydroxyphenyl)-2-methoxyacetamide

N-(4-hydroxyphenyl)-2-methoxyacetamide (PubChem CID 836717) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-methoxyacetamide
PubChem CID836717
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC NameN-(4-hydroxyphenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C9H11NO3/c1-13-6-9(12)10-7-2-4-8(11)5-3-7/h2-5,11H,6H2,1H3,(H,10,12)
InChIKeyNSZUGQROUUTGGI-UHFFFAOYSA-N
XLogP0.98
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Acetaminophen
CID 1983
2-Acetamidophenol
CID 11972
Acetaminophen sulfate
CID 83939
AM404
CID 6604822
Octadecanamide, N-(4-hydroxyphenyl)-
CID 7689
N-(4-Hydroxyphenyl)propanamide
CID 74325
4-(4-Hydroxyanilino)-4-oxobutanoic acid
CID 605610
4'-Hydroxybutyranilide
CID 66874
N-(4-hydroxyphenyl)dodecanamide
CID 66902
4-(4-Hydroxyanilino)-4-oxo-2-butenoic acid
CID 1201178
2-Propenamide, N-(4-hydroxyphenyl)-2-methyl-
CID 29520
N-(4-hydroxyphenyl)acrylamide
CID 36830

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-methoxyacetamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-methoxyacetamide (CID 836717) is N-(4-hydroxyphenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-methoxyacetamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-methoxyacetamide is COCC(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-2-methoxyacetamide?
The InChIKey is NSZUGQROUUTGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO3/c1-13-6-9(12)10-7-2-4-8(11)5-3-7/h2-5,11H,6H2,1H3,(H,10,12).
What are the key properties of N-(4-hydroxyphenyl)-2-methoxyacetamide?
N-(4-hydroxyphenyl)-2-methoxyacetamide has a molecular weight of 181.19 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-methoxyacetamide is sourced from PubChem (CID 836717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).