N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide

C10H12N2O4 — CID 103958323

IUPACN-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)NOCC(N)=O)ccc1O
InChIInChI=1S/C10H12N2O4/c1-6-4-7(2-3-8(6)13)10(15)12-16-5-9(11)14/h2-4,13H,5H2,1H3,(H2,11,14)(H,12,15)
InChIKeyMKAOWPMCYKTLFH-UHFFFAOYSA-N
MW224.22 g/mol
LogP-0.15
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide

N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide (PubChem CID 103958323) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide
PubChem CID103958323
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC NameN-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)NOCC(N)=O)ccc1O
InChIInChI=1S/C10H12N2O4/c1-6-4-7(2-3-8(6)13)10(15)12-16-5-9(11)14/h2-4,13H,5H2,1H3,(H2,11,14)(H,12,15)
InChIKeyMKAOWPMCYKTLFH-UHFFFAOYSA-N
XLogP-0.15
TPSA101.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide 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

4-hydroxy-3-methyl-N-(2-methylpropoxy)benzamide
CID 103956177
N-(2-amino-2-oxoethoxy)-3-bromo-4-methoxybenzamide
CID 112550861
4-amino-N-(2-amino-2-oxoethoxy)-3-bromobenzamide
CID 112674135
N-(2-amino-2-oxoethoxy)-2-chloropyridine-4-carboxamide
CID 103901221
N-(1-amino-1-sulfanylidenebutan-2-yl)-4-hydroxy-3-methylbenzamide
CID 107675964
2-[(4-hydroxy-3,5-dimethylbenzoyl)amino]oxyacetic acid
CID 166286482
N-(2-amino-2-oxoethoxy)-4-(methylsulfanylmethyl)benzamide
CID 112550855
N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide
CID 112551215
methyl 4-hydroxy-3-methylbenzoate;propane
CID 145380615
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-4-hydroxy-3-methylbenzamide
CID 114008304
N-(2-amino-2-oxoethoxy)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 112550534
4-hydroxy-N-(3-hydroxybutyl)-3-methylbenzamide
CID 103956091

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide (CID 103958323) is N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide is Cc1cc(C(=O)NOCC(N)=O)ccc1O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide?
The InChIKey is MKAOWPMCYKTLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-6-4-7(2-3-8(6)13)10(15)12-16-5-9(11)14/h2-4,13H,5H2,1H3,(H2,11,14)(H,12,15).
What are the key properties of N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide?
N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide has a molecular weight of 224.22 g/mol, XLogP of -0.15, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide is sourced from PubChem (CID 103958323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).