3-[hydroxy(oxido)amino]benzohydrazide

C7H8N3O3- — CID 163158257

IUPAC3-[hydroxy(oxido)amino]benzohydrazide
SMILESNNC(=O)c1cccc(N([O-])O)c1
InChIInChI=1S/C7H8N3O3/c8-9-7(11)5-2-1-3-6(4-5)10(12)13/h1-4,12H,8H2,(H,9,11)/q-1
InChIKeyBPPWXDVIOFXLLJ-UHFFFAOYSA-N
MW182.16 g/mol
LogP-0.02
Rot. Bonds2

About 3-[hydroxy(oxido)amino]benzohydrazide

3-[hydroxy(oxido)amino]benzohydrazide (PubChem CID 163158257) has the molecular formula C7H8N3O3- and a molecular weight of 182.16 g/mol. Its IUPAC name is 3-[hydroxy(oxido)amino]benzohydrazide.

Molecular Properties

Compound Name3-[hydroxy(oxido)amino]benzohydrazide
PubChem CID163158257
Molecular FormulaC7H8N3O3-
Molecular Weight182.16 g/mol
Exact Mass182.06
IUPAC Name3-[hydroxy(oxido)amino]benzohydrazide
SMILESNNC(=O)c1cccc(N([O-])O)c1
InChIInChI=1S/C7H8N3O3/c8-9-7(11)5-2-1-3-6(4-5)10(12)13/h1-4,12H,8H2,(H,9,11)/q-1
InChIKeyBPPWXDVIOFXLLJ-UHFFFAOYSA-N
XLogP-0.02
TPSA101.65 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.16
LogP ≤ 5-0.02
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[[3-[hydroxy(oxido)amino]benzoyl]amino]-3-phenylurea
CID 163182175
N-(furan-2-ylmethylideneamino)-3-[hydroxy(oxido)amino]benzamide
CID 163138567
3-prop-2-enylbenzohydrazide
CID 20555786
3-[[(1-hydroxy-2-methylpropan-2-yl)-methylamino]methyl]benzohydrazide
CID 113476702
3-(diethylaminomethyl)benzohydrazide
CID 63571195
methyl 3-(hydrazinecarbonyl)benzoate;hydrochloride
CID 122507435
3-chlorobenzohydrazide;bis(formonitrile)
CID 175536479
benzohydrazide;molybdenum
CID 162076561
ethyl 3-(hydrazinecarbonyl)benzoate
CID 131844336
3-(cyanomethyl)benzohydrazide
CID 68715824
3-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 43390448
3-[3-[(dimethylamino)methyl]phenyl]benzohydrazide
CID 177345259

Frequently Asked Questions

What is the IUPAC name of 3-[hydroxy(oxido)amino]benzohydrazide?
The IUPAC name of 3-[hydroxy(oxido)amino]benzohydrazide (CID 163158257) is 3-[hydroxy(oxido)amino]benzohydrazide.
What is the SMILES notation for 3-[hydroxy(oxido)amino]benzohydrazide?
The canonical SMILES for 3-[hydroxy(oxido)amino]benzohydrazide is NNC(=O)c1cccc(N([O-])O)c1.
What is the InChIKey of 3-[hydroxy(oxido)amino]benzohydrazide?
The InChIKey is BPPWXDVIOFXLLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3O3/c8-9-7(11)5-2-1-3-6(4-5)10(12)13/h1-4,12H,8H2,(H,9,11)/q-1.
What are the key properties of 3-[hydroxy(oxido)amino]benzohydrazide?
3-[hydroxy(oxido)amino]benzohydrazide has a molecular weight of 182.16 g/mol, XLogP of -0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[hydroxy(oxido)amino]benzohydrazide is sourced from PubChem (CID 163158257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).