N-(4-hydroxyphenyl)acetamide;iron

C8H9FeNO2 — CID 69304461

IUPACN-(4-hydroxyphenyl)acetamide;iron
SMILESCC(=O)Nc1ccc(O)cc1.[Fe]
InChIInChI=1S/C8H9NO2.Fe/c1-6(10)9-7-2-4-8(11)5-3-7;/h2-5,11H,1H3,(H,9,10);
InChIKeyDGABHQIHQMEUJY-UHFFFAOYSA-N
MW207.01 g/mol
LogP1.35
Rot. Bonds1

About N-(4-hydroxyphenyl)acetamide;iron

N-(4-hydroxyphenyl)acetamide;iron (PubChem CID 69304461) has the molecular formula C8H9FeNO2 and a molecular weight of 207.01 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)acetamide;iron.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)acetamide;iron
PubChem CID69304461
Molecular FormulaC8H9FeNO2
Molecular Weight207.01 g/mol
Exact Mass207.00
IUPAC NameN-(4-hydroxyphenyl)acetamide;iron
SMILESCC(=O)Nc1ccc(O)cc1.[Fe]
InChIInChI=1S/C8H9NO2.Fe/c1-6(10)9-7-2-4-8(11)5-3-7;/h2-5,11H,1H3,(H,9,10);
InChIKeyDGABHQIHQMEUJY-UHFFFAOYSA-N
XLogP1.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.01
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-hydroxyphenyl)acetamide;iron with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-hydroxyphenyl)acetamide;dihydrate
CID 140999210
bis(N-(4-hydroxyphenyl)acetamide);zirconium(2+);dichloride
CID 174353959
lithium;hydride;N-(4-hydroxyphenyl)acetamide;hexahydrate
CID 173295896
N-(4-hydroxyphenyl)acetamide;N-phenylacetamide
CID 174809741
N-[4-(4-hydroxybenzoyl)phenyl]acetamide
CID 91710939
N-(4-hydroxyphenyl)acetamide;piperazine
CID 67107882
N-[4-[4-[(4-hydroxyphenyl)diazenyl]phenyl]phenyl]acetamide
CID 137186099
bis(N-(4-hydroxyphenyl)acetamide);morpholine
CID 86210685
N-(4-methylphenyl)acetamide
CID 7684
N-[4-(3,5-dihydroxyanilino)phenyl]acetamide
CID 139679971
N-(4-iodophenyl)acetamide
CID 12147
CID 59006143
CID 59006143

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)acetamide;iron?
The IUPAC name of N-(4-hydroxyphenyl)acetamide;iron (CID 69304461) is N-(4-hydroxyphenyl)acetamide;iron.
What is the SMILES notation for N-(4-hydroxyphenyl)acetamide;iron?
The canonical SMILES for N-(4-hydroxyphenyl)acetamide;iron is CC(=O)Nc1ccc(O)cc1.[Fe].
What is the InChIKey of N-(4-hydroxyphenyl)acetamide;iron?
The InChIKey is DGABHQIHQMEUJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2.Fe/c1-6(10)9-7-2-4-8(11)5-3-7;/h2-5,11H,1H3,(H,9,10);.
What are the key properties of N-(4-hydroxyphenyl)acetamide;iron?
N-(4-hydroxyphenyl)acetamide;iron has a molecular weight of 207.01 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)acetamide;iron is sourced from PubChem (CID 69304461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).