N'-acetyl-2,6-dihydroxybenzohydrazide

C9H10N2O4 — CID 139076787

IUPACN'-acetyl-2,6-dihydroxybenzohydrazide
SMILESCC(=O)NNC(=O)c1c(O)cccc1O
InChIInChI=1S/C9H10N2O4/c1-5(12)10-11-9(15)8-6(13)3-2-4-7(8)14/h2-4,13-14H,1H3,(H,10,12)(H,11,15)
InChIKeyQWVPYBKYDGVFPR-UHFFFAOYSA-N
MW210.19 g/mol
LogP-0.12
Rot. Bonds1

About N'-acetyl-2,6-dihydroxybenzohydrazide

N'-acetyl-2,6-dihydroxybenzohydrazide (PubChem CID 139076787) has the molecular formula C9H10N2O4 and a molecular weight of 210.19 g/mol. Its IUPAC name is N'-acetyl-2,6-dihydroxybenzohydrazide.

Molecular Properties

Compound NameN'-acetyl-2,6-dihydroxybenzohydrazide
PubChem CID139076787
Molecular FormulaC9H10N2O4
Molecular Weight210.19 g/mol
Exact Mass210.06
IUPAC NameN'-acetyl-2,6-dihydroxybenzohydrazide
SMILESCC(=O)NNC(=O)c1c(O)cccc1O
InChIInChI=1S/C9H10N2O4/c1-5(12)10-11-9(15)8-6(13)3-2-4-7(8)14/h2-4,13-14H,1H3,(H,10,12)(H,11,15)
InChIKeyQWVPYBKYDGVFPR-UHFFFAOYSA-N
XLogP-0.12
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 5-0.12
H-Bond Donors ≤ 54
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-(3-acetamidophenyl)-2,6-dihydroxybenzamide
CID 103748896
2,6-dihydroxy-N-(2-oxopropyl)benzamide
CID 107688759
N'-acetyl-4-hydroxy-1-benzofuran-2-carbohydrazide
CID 22728939
2,6-dihydroxy-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]benzamide
CID 107689580
2,6-dihydroxy-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 107690240
N-[4-(acetamidocarbamoyl)-3-hydroxyphenyl]acetamide
CID 102522207
N-cyclopent-3-en-1-yl-2,6-dihydroxybenzamide
CID 103890634
2,6-dihydroxy-N-(2-propan-2-ylcyclohexyl)benzamide
CID 107689521
N'-acetyl-2-hydroxy-5-nitrobenzohydrazide
CID 102383620
N-[3-(aminomethyl)pentan-3-yl]-2,6-dihydroxybenzamide
CID 107690286
N-[1-chloro-2-(chloromethyl)butan-2-yl]-2,6-dihydroxybenzamide
CID 107867672
2,6-dihydroxy-N-(2-methoxyethyl)benzamide
CID 103748859

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2,6-dihydroxybenzohydrazide?
The IUPAC name of N'-acetyl-2,6-dihydroxybenzohydrazide (CID 139076787) is N'-acetyl-2,6-dihydroxybenzohydrazide.
What is the SMILES notation for N'-acetyl-2,6-dihydroxybenzohydrazide?
The canonical SMILES for N'-acetyl-2,6-dihydroxybenzohydrazide is CC(=O)NNC(=O)c1c(O)cccc1O.
What is the InChIKey of N'-acetyl-2,6-dihydroxybenzohydrazide?
The InChIKey is QWVPYBKYDGVFPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O4/c1-5(12)10-11-9(15)8-6(13)3-2-4-7(8)14/h2-4,13-14H,1H3,(H,10,12)(H,11,15).
What are the key properties of N'-acetyl-2,6-dihydroxybenzohydrazide?
N'-acetyl-2,6-dihydroxybenzohydrazide has a molecular weight of 210.19 g/mol, XLogP of -0.12, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2,6-dihydroxybenzohydrazide is sourced from PubChem (CID 139076787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).