N-acetyl-2-hydroxybenzamide

C9H9NO3 — CID 10252

IUPACN-acetyl-2-hydroxybenzamide
SMILESCC(=O)NC(=O)c1ccccc1O
InChIInChI=1S/C9H9NO3/c1-6(11)10-9(13)7-4-2-3-5-8(7)12/h2-5,12H,1H3,(H,10,11,13)
InChIKeyJZWFDVDETGFGFC-UHFFFAOYSA-N
MW179.17 g/mol
LogP0.67
Rot. Bonds1

About N-acetyl-2-hydroxybenzamide

N-acetyl-2-hydroxybenzamide (PubChem CID 10252) has the molecular formula C9H9NO3 and a molecular weight of 179.17 g/mol. Its IUPAC name is N-acetyl-2-hydroxybenzamide.

Molecular Properties

Compound NameN-acetyl-2-hydroxybenzamide
PubChem CID10252
Molecular FormulaC9H9NO3
Molecular Weight179.17 g/mol
Exact Mass179.06
IUPAC NameN-acetyl-2-hydroxybenzamide
SMILESCC(=O)NC(=O)c1ccccc1O
InChIInChI=1S/C9H9NO3/c1-6(11)10-9(13)7-4-2-3-5-8(7)12/h2-5,12H,1H3,(H,10,11,13)
InChIKeyJZWFDVDETGFGFC-UHFFFAOYSA-N
XLogP0.67
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.17
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Salicylamide
CID 5147
Salicyluric Acid
CID 10253
Salicylhydroxamic Acid
CID 66644
Salicylanilide
CID 6872
Buclosamide
CID 68466
Salicylic acid, hydrazide
CID 13637
Edasalonexent
CID 44626120
N,N'-1,2-Ethanediylbis(2-hydroxybenzamide)
CID 95934
Benzamide, N,N'-1,6-hexanediylbis(2-hydroxy-
CID 209651
Salicylic acid ethanolamide
CID 90407
2-Hydroxy-N,N-dimethylbenzamide
CID 74500
N-Methylsalicylamide
CID 74624

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-hydroxybenzamide?
The IUPAC name of N-acetyl-2-hydroxybenzamide (CID 10252) is N-acetyl-2-hydroxybenzamide.
What is the SMILES notation for N-acetyl-2-hydroxybenzamide?
The canonical SMILES for N-acetyl-2-hydroxybenzamide is CC(=O)NC(=O)c1ccccc1O.
What is the InChIKey of N-acetyl-2-hydroxybenzamide?
The InChIKey is JZWFDVDETGFGFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO3/c1-6(11)10-9(13)7-4-2-3-5-8(7)12/h2-5,12H,1H3,(H,10,11,13).
What are the key properties of N-acetyl-2-hydroxybenzamide?
N-acetyl-2-hydroxybenzamide has a molecular weight of 179.17 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-hydroxybenzamide is sourced from PubChem (CID 10252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).