2-hydroxy-3-nitrobenzohydrazide

C7H7N3O4 — CID 11367606

IUPAC2-hydroxy-3-nitrobenzohydrazide
SMILESNNC(=O)c1cccc([N+](=O)[O-])c1O
InChIInChI=1S/C7H7N3O4/c8-9-7(12)4-2-1-3-5(6(4)11)10(13)14/h1-3,11H,8H2,(H,9,12)
InChIKeyVOIQCDFMTVQLRZ-UHFFFAOYSA-N
MW197.15 g/mol
LogP-0.10
Rot. Bonds2

About 2-hydroxy-3-nitrobenzohydrazide

2-hydroxy-3-nitrobenzohydrazide (PubChem CID 11367606) has the molecular formula C7H7N3O4 and a molecular weight of 197.15 g/mol. Its IUPAC name is 2-hydroxy-3-nitrobenzohydrazide.

Molecular Properties

Compound Name2-hydroxy-3-nitrobenzohydrazide
PubChem CID11367606
Molecular FormulaC7H7N3O4
Molecular Weight197.15 g/mol
Exact Mass197.04
IUPAC Name2-hydroxy-3-nitrobenzohydrazide
SMILESNNC(=O)c1cccc([N+](=O)[O-])c1O
InChIInChI=1S/C7H7N3O4/c8-9-7(12)4-2-1-3-5(6(4)11)10(13)14/h1-3,11H,8H2,(H,9,12)
InChIKeyVOIQCDFMTVQLRZ-UHFFFAOYSA-N
XLogP-0.10
TPSA118.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.15
LogP ≤ 5-0.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

CID 58418423
CID 58418423
2-hydroxy-3-nitro-N-prop-2-ynylbenzamide
CID 103746299
2-hydroxy-3-nitro-N-(2-sulfamoylethyl)benzamide
CID 103800076
2-hydroxy-3-nitro-N-phenylbenzamide;2-hydroxy-N-phenylbenzamide
CID 157455214
N-but-3-ynyl-2-hydroxy-3-nitrobenzamide
CID 113264555
2-hydroxy-3-nitro-N-(2,4,4-trimethylpentan-2-yl)benzamide
CID 20715419
N-(3,5-dimethylphenyl)-2-hydroxy-3-nitrobenzamide
CID 102740831
N-(3-ethylpentan-2-yl)-2-hydroxy-3-nitrobenzamide
CID 102741844
2-hydroxy-3-nitro-N-octylbenzamide
CID 107076295
N-(1,3-dihydroisoindol-2-yl)-2-hydroxy-3-nitrobenzamide
CID 97087687
2-hydroxy-N-(2-methylsulfanylpropyl)-3-nitrobenzamide
CID 113322559
2-hydroxy-3-nitro-N-(2H-tetrazol-5-yl)benzamide
CID 12962786

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-nitrobenzohydrazide?
The IUPAC name of 2-hydroxy-3-nitrobenzohydrazide (CID 11367606) is 2-hydroxy-3-nitrobenzohydrazide.
What is the SMILES notation for 2-hydroxy-3-nitrobenzohydrazide?
The canonical SMILES for 2-hydroxy-3-nitrobenzohydrazide is NNC(=O)c1cccc([N+](=O)[O-])c1O.
What is the InChIKey of 2-hydroxy-3-nitrobenzohydrazide?
The InChIKey is VOIQCDFMTVQLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O4/c8-9-7(12)4-2-1-3-5(6(4)11)10(13)14/h1-3,11H,8H2,(H,9,12).
What are the key properties of 2-hydroxy-3-nitrobenzohydrazide?
2-hydroxy-3-nitrobenzohydrazide has a molecular weight of 197.15 g/mol, XLogP of -0.10, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-nitrobenzohydrazide is sourced from PubChem (CID 11367606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).