N'-oxidobenzohydrazide

C7H7N2O2- — CID 174971627

IUPACN'-oxidobenzohydrazide
SMILESO=C(NN[O-])c1ccccc1
InChIInChI=1S/C7H7N2O2/c10-7(8-9-11)6-4-2-1-3-5-6/h1-5,9H,(H,8,10)/q-1
InChIKeyZKBNBBJDKRJUHF-UHFFFAOYSA-N
MW151.14 g/mol
LogP0.42
Rot. Bonds2

About N'-oxidobenzohydrazide

N'-oxidobenzohydrazide (PubChem CID 174971627) has the molecular formula C7H7N2O2- and a molecular weight of 151.14 g/mol. Its IUPAC name is N'-oxidobenzohydrazide.

Molecular Properties

Compound NameN'-oxidobenzohydrazide
PubChem CID174971627
Molecular FormulaC7H7N2O2-
Molecular Weight151.14 g/mol
Exact Mass151.05
IUPAC NameN'-oxidobenzohydrazide
SMILESO=C(NN[O-])c1ccccc1
InChIInChI=1S/C7H7N2O2/c10-7(8-9-11)6-4-2-1-3-5-6/h1-5,9H,(H,8,10)/q-1
InChIKeyZKBNBBJDKRJUHF-UHFFFAOYSA-N
XLogP0.42
TPSA64.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-oxidobenzohydrazide 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

lead(2+);bis(N-oxidobenzamide)
CID 174994108
N'-(hydroxymethyl)benzohydrazide
CID 130128548
N'-(2-oxo-2-phenylacetyl)benzohydrazide
CID 12792453
N'-(2,4-dioxo-4-phenylbutanoyl)benzohydrazide
CID 4049162
benzamidothiourea
CID 781748
4-[4-(benzamidocarbamoyl)phenoxy]-N'-benzoylbenzohydrazide
CID 21231530
4-(2-benzoylhydrazinyl)-4-oxobutanoate
CID 2165242
CID 70387554
CID 70387554
N-methylbenzamide
CID 11954
N-hydroxybenzamide;nickel
CID 88846751
2-amino-1-benzamidoguanidine
CID 55280611
CID 66812751
CID 66812751

Frequently Asked Questions

What is the IUPAC name of N'-oxidobenzohydrazide?
The IUPAC name of N'-oxidobenzohydrazide (CID 174971627) is N'-oxidobenzohydrazide.
What is the SMILES notation for N'-oxidobenzohydrazide?
The canonical SMILES for N'-oxidobenzohydrazide is O=C(NN[O-])c1ccccc1.
What is the InChIKey of N'-oxidobenzohydrazide?
The InChIKey is ZKBNBBJDKRJUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N2O2/c10-7(8-9-11)6-4-2-1-3-5-6/h1-5,9H,(H,8,10)/q-1.
What are the key properties of N'-oxidobenzohydrazide?
N'-oxidobenzohydrazide has a molecular weight of 151.14 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-oxidobenzohydrazide is sourced from PubChem (CID 174971627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).