N-(4-hydroxyphenyl)-2-methylprop-2-enamide

C10H11NO2 — CID 29520

IUPACN-(4-hydroxyphenyl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C10H11NO2/c1-7(2)10(13)11-8-3-5-9(12)6-4-8/h3-6,12H,1H2,2H3,(H,11,13)
InChIKeyXZSZONUJSGDIFI-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.91
Rot. Bonds2

About N-(4-hydroxyphenyl)-2-methylprop-2-enamide

N-(4-hydroxyphenyl)-2-methylprop-2-enamide (PubChem CID 29520) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-methylprop-2-enamide
PubChem CID29520
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC NameN-(4-hydroxyphenyl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C10H11NO2/c1-7(2)10(13)11-8-3-5-9(12)6-4-8/h3-6,12H,1H2,2H3,(H,11,13)
InChIKeyXZSZONUJSGDIFI-UHFFFAOYSA-N
XLogP1.91
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-(4-hydroxyphenyl)-2-methylprop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-methylprop-2-enamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-methylprop-2-enamide (CID 29520) is N-(4-hydroxyphenyl)-2-methylprop-2-enamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-methylprop-2-enamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-methylprop-2-enamide is C=C(C)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-2-methylprop-2-enamide?
The InChIKey is XZSZONUJSGDIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-7(2)10(13)11-8-3-5-9(12)6-4-8/h3-6,12H,1H2,2H3,(H,11,13).
What are the key properties of N-(4-hydroxyphenyl)-2-methylprop-2-enamide?
N-(4-hydroxyphenyl)-2-methylprop-2-enamide has a molecular weight of 177.20 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-methylprop-2-enamide is sourced from PubChem (CID 29520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).