N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide

C9H9FN2O4 — CID 112551215

IUPACN-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide
SMILESNC(=O)CONC(=O)c1cc(F)ccc1O
InChIInChI=1S/C9H9FN2O4/c10-5-1-2-7(13)6(3-5)9(15)12-16-4-8(11)14/h1-3,13H,4H2,(H2,11,14)(H,12,15)
InChIKeyOEHFTAAOYIPQAT-UHFFFAOYSA-N
MW228.18 g/mol
LogP-0.32
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide

N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide (PubChem CID 112551215) has the molecular formula C9H9FN2O4 and a molecular weight of 228.18 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide
PubChem CID112551215
Molecular FormulaC9H9FN2O4
Molecular Weight228.18 g/mol
Exact Mass228.05
IUPAC NameN-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide
SMILESNC(=O)CONC(=O)c1cc(F)ccc1O
InChIInChI=1S/C9H9FN2O4/c10-5-1-2-7(13)6(3-5)9(15)12-16-4-8(11)14/h1-3,13H,4H2,(H2,11,14)(H,12,15)
InChIKeyOEHFTAAOYIPQAT-UHFFFAOYSA-N
XLogP-0.32
TPSA101.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.18
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-2-oxoethoxy)-5-fluoro-2-methylbenzamide
CID 112550764
N-(2-amino-2-oxoethoxy)-5-chloro-2-fluorobenzamide
CID 112551004
5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 67742481
N-(2-carbamothioyl-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 82683463
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
N-(2-amino-2-oxoethoxy)-4-hydroxy-3-methylbenzamide
CID 103958323
5-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962771
ethyl 2-[(5-fluoro-2-hydroxybenzoyl)amino]propanoate
CID 115298966
2-[(2,4-difluorophenyl)carbamoylamino]oxyacetamide
CID 113351033
N-(2-amino-2-oxoethoxy)-3,4,5-trifluorobenzamide
CID 112619998
1-(5-fluoro-2-hydroxyphenyl)-2-(methylamino)ethanone
CID 82601575
N-(2-amino-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298308

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide (CID 112551215) is N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide is NC(=O)CONC(=O)c1cc(F)ccc1O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide?
The InChIKey is OEHFTAAOYIPQAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2O4/c10-5-1-2-7(13)6(3-5)9(15)12-16-4-8(11)14/h1-3,13H,4H2,(H2,11,14)(H,12,15).
What are the key properties of N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide?
N-(2-amino-2-oxoethoxy)-5-fluoro-2-hydroxybenzamide has a molecular weight of 228.18 g/mol, XLogP of -0.32, 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)-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 112551215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).