N'-(2-nitrophenyl)benzohydrazide

C13H11N3O3 — CID 3718054

IUPACN'-(2-nitrophenyl)benzohydrazide
SMILESO=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1
InChIInChI=1S/C13H11N3O3/c17-13(10-6-2-1-3-7-10)15-14-11-8-4-5-9-12(11)16(18)19/h1-9,14H,(H,15,17)
InChIKeyOALXUDSQCVXRJC-UHFFFAOYSA-N
MW257.25 g/mol
LogP2.35
Rot. Bonds4

About N'-(2-nitrophenyl)benzohydrazide

N'-(2-nitrophenyl)benzohydrazide (PubChem CID 3718054) has the molecular formula C13H11N3O3 and a molecular weight of 257.25 g/mol. Its IUPAC name is N'-(2-nitrophenyl)benzohydrazide.

Molecular Properties

Compound NameN'-(2-nitrophenyl)benzohydrazide
PubChem CID3718054
Molecular FormulaC13H11N3O3
Molecular Weight257.25 g/mol
Exact Mass257.08
IUPAC NameN'-(2-nitrophenyl)benzohydrazide
SMILESO=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1
InChIInChI=1S/C13H11N3O3/c17-13(10-6-2-1-3-7-10)15-14-11-8-4-5-9-12(11)16(18)19/h1-9,14H,(H,15,17)
InChIKeyOALXUDSQCVXRJC-UHFFFAOYSA-N
XLogP2.35
TPSA84.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-benzamido-3-(2-nitrophenyl)urea
CID 91390180
N'-(2-nitro-3-pyridinyl)benzohydrazide
CID 14387403
(E)-N'-(2-nitrophenyl)-3-phenylprop-2-enehydrazide
CID 6132769
N-(2-nitrophenyl)benzamide;2-oxo-2-(sulfonylamino)acetic acid
CID 159771520
2,5-dimethyl-N'-(2-nitrophenyl)benzohydrazide
CID 17397799
4-iodo-N-(2-nitrophenyl)benzamide
CID 2889506
N'-(3-nitro-2-oxo-1H-pyridin-4-yl)benzohydrazide
CID 157453648
N'-(1-methyl-4-nitropyrazol-3-yl)benzohydrazide
CID 3958331
N-[3-(2-nitroanilino)-3-oxopropyl]benzamide
CID 62707198
N-[(1S)-2,2,2-tribromo-1-(2-nitroanilino)ethyl]benzamide
CID 98092764
4-bromo-N-(2-nitrophenyl)benzamide
CID 139086571
1-chloro-2-(2-nitrophenyl)hydrazine
CID 88943642

Frequently Asked Questions

What is the IUPAC name of N'-(2-nitrophenyl)benzohydrazide?
The IUPAC name of N'-(2-nitrophenyl)benzohydrazide (CID 3718054) is N'-(2-nitrophenyl)benzohydrazide.
What is the SMILES notation for N'-(2-nitrophenyl)benzohydrazide?
The canonical SMILES for N'-(2-nitrophenyl)benzohydrazide is O=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1.
What is the InChIKey of N'-(2-nitrophenyl)benzohydrazide?
The InChIKey is OALXUDSQCVXRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O3/c17-13(10-6-2-1-3-7-10)15-14-11-8-4-5-9-12(11)16(18)19/h1-9,14H,(H,15,17).
What are the key properties of N'-(2-nitrophenyl)benzohydrazide?
N'-(2-nitrophenyl)benzohydrazide has a molecular weight of 257.25 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-nitrophenyl)benzohydrazide is sourced from PubChem (CID 3718054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).