3-acetamido-N-(2-hydroxyphenyl)propanamide

C11H14N2O3 — CID 47110153

IUPAC3-acetamido-N-(2-hydroxyphenyl)propanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1O
InChIInChI=1S/C11H14N2O3/c1-8(14)12-7-6-11(16)13-9-4-2-3-5-10(9)15/h2-5,15H,6-7H2,1H3,(H,12,14)(H,13,16)
InChIKeyLKFFQSIMRFOKMB-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.86
Rot. Bonds4

About 3-acetamido-N-(2-hydroxyphenyl)propanamide

3-acetamido-N-(2-hydroxyphenyl)propanamide (PubChem CID 47110153) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 3-acetamido-N-(2-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(2-hydroxyphenyl)propanamide
PubChem CID47110153
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name3-acetamido-N-(2-hydroxyphenyl)propanamide
SMILESCC(=O)NCCC(=O)Nc1ccccc1O
InChIInChI=1S/C11H14N2O3/c1-8(14)12-7-6-11(16)13-9-4-2-3-5-10(9)15/h2-5,15H,6-7H2,1H3,(H,12,14)(H,13,16)
InChIKeyLKFFQSIMRFOKMB-UHFFFAOYSA-N
XLogP0.86
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-acetamido-N-(2-hydroxyphenyl)propanamide 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

2-(3-acetamidopropanoylamino)-N-methylbenzamide
CID 110606657
3-acetamido-N-phenylpropanamide
CID 7946185
ethane;N-(2-hydroxyphenyl)butanamide
CID 142538893
3-acetamido-N-[2-(4-methylphenoxy)phenyl]propanamide
CID 38505087
3-[(2-hydroxyphenyl)carbamoylamino]propanoic acid
CID 117235776
2-(3-acetamidopropanoylamino)-5-hydroxybenzoic acid
CID 61405990
4-(2-hydroxyanilino)-4-oxobutanoate
CID 3615801
N-(2-hydroxyphenyl)-2-iodoacetamide
CID 66791865
2,4-difluoro-N-[3-(2-hydroxyanilino)-3-oxopropyl]benzamide
CID 51314532
(Z)-N-(2-hydroxyphenyl)octadec-9-enamide
CID 52916764
3-(2-hydroxyanilino)-3-oxopropanoic acid
CID 69016240
[2-(2-bromoanilino)-2-oxoethyl] 3-acetamidopropanoate
CID 7197888

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(2-hydroxyphenyl)propanamide?
The IUPAC name of 3-acetamido-N-(2-hydroxyphenyl)propanamide (CID 47110153) is 3-acetamido-N-(2-hydroxyphenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(2-hydroxyphenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(2-hydroxyphenyl)propanamide is CC(=O)NCCC(=O)Nc1ccccc1O.
What is the InChIKey of 3-acetamido-N-(2-hydroxyphenyl)propanamide?
The InChIKey is LKFFQSIMRFOKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-8(14)12-7-6-11(16)13-9-4-2-3-5-10(9)15/h2-5,15H,6-7H2,1H3,(H,12,14)(H,13,16).
What are the key properties of 3-acetamido-N-(2-hydroxyphenyl)propanamide?
3-acetamido-N-(2-hydroxyphenyl)propanamide has a molecular weight of 222.24 g/mol, XLogP of 0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(2-hydroxyphenyl)propanamide is sourced from PubChem (CID 47110153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).