3-acetamido-2-hydroxybenzamide

C9H10N2O3 — CID 66833068

IUPAC3-acetamido-2-hydroxybenzamide
SMILESCC(=O)Nc1cccc(C(N)=O)c1O
InChIInChI=1S/C9H10N2O3/c1-5(12)11-7-4-2-3-6(8(7)13)9(10)14/h2-4,13H,1H3,(H2,10,14)(H,11,12)
InChIKeyFQHOKEVHOLRUCY-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.45
Rot. Bonds2

About 3-acetamido-2-hydroxybenzamide

3-acetamido-2-hydroxybenzamide (PubChem CID 66833068) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 3-acetamido-2-hydroxybenzamide.

Molecular Properties

Compound Name3-acetamido-2-hydroxybenzamide
PubChem CID66833068
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name3-acetamido-2-hydroxybenzamide
SMILESCC(=O)Nc1cccc(C(N)=O)c1O
InChIInChI=1S/C9H10N2O3/c1-5(12)11-7-4-2-3-6(8(7)13)9(10)14/h2-4,13H,1H3,(H2,10,14)(H,11,12)
InChIKeyFQHOKEVHOLRUCY-UHFFFAOYSA-N
XLogP0.45
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxybenzene-1,3-dicarboxamide
CID 22594874
3-[(2-bromophenyl)carbamoylamino]-2-hydroxybenzamide
CID 10383212
3-acetamido-2-nitrobenzamide
CID 142159478
2-hydroxy-3-(pentylamino)benzamide
CID 67175041
3-acetamido-2-[(2,2,2-trifluoroacetyl)amino]benzamide
CID 151481142
2-hydroxy-3-[(4-methyl-2,5-dioxopyrrol-3-yl)amino]benzamide
CID 142233998
sodium 2-acetamidobenzoate
CID 23702638
N-[2-[(Z)-N'-hydroxycarbamimidoyl]phenyl]acetamide
CID 139085269
(3-acetamido-2-hydroxyphenyl)arsonic acid
CID 154325288
3-(2-acetamidopropanoylamino)-2-hydroxybenzoic acid
CID 113458409
N-[2-(2-acetamido-6-methylphenyl)-3-methylphenyl]acetamide
CID 22971546
N-[3-[(2-acetamidophenyl)diazenyl]-2-hydroxyphenyl]acetamide
CID 541079

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-2-hydroxybenzamide?
The IUPAC name of 3-acetamido-2-hydroxybenzamide (CID 66833068) is 3-acetamido-2-hydroxybenzamide.
What is the SMILES notation for 3-acetamido-2-hydroxybenzamide?
The canonical SMILES for 3-acetamido-2-hydroxybenzamide is CC(=O)Nc1cccc(C(N)=O)c1O.
What is the InChIKey of 3-acetamido-2-hydroxybenzamide?
The InChIKey is FQHOKEVHOLRUCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-5(12)11-7-4-2-3-6(8(7)13)9(10)14/h2-4,13H,1H3,(H2,10,14)(H,11,12).
What are the key properties of 3-acetamido-2-hydroxybenzamide?
3-acetamido-2-hydroxybenzamide has a molecular weight of 194.19 g/mol, XLogP of 0.45, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-2-hydroxybenzamide is sourced from PubChem (CID 66833068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).