3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol

C12H10N4O3 — CID 5356182

IUPAC3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol
SMILESO=[N+]([O-])c1ccc(N/N=C\c2cccc(O)c2)nc1
InChIInChI=1S/C12H10N4O3/c17-11-3-1-2-9(6-11)7-14-15-12-5-4-10(8-13-12)16(18)19/h1-8,17H,(H,13,15)/b14-7-
InChIKeyOJVHJJXXKPNJMP-AUWJEWJLSA-N
MW258.24 g/mol
LogP2.14
Rot. Bonds4

About 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol

3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol (PubChem CID 5356182) has the molecular formula C12H10N4O3 and a molecular weight of 258.24 g/mol. Its IUPAC name is 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol.

Molecular Properties

Compound Name3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol
PubChem CID5356182
Molecular FormulaC12H10N4O3
Molecular Weight258.24 g/mol
Exact Mass258.08
IUPAC Name3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol
SMILESO=[N+]([O-])c1ccc(N/N=C\c2cccc(O)c2)nc1
InChIInChI=1S/C12H10N4O3/c17-11-3-1-2-9(6-11)7-14-15-12-5-4-10(8-13-12)16(18)19/h1-8,17H,(H,13,15)/b14-7-
InChIKeyOJVHJJXXKPNJMP-AUWJEWJLSA-N
XLogP2.14
TPSA100.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol 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

m-Anisaldehyde, 2-hydroxy-, (5-nitro-2-pyridyl)hydrazone
CID 135473369
2,3-Dimethoxybenzaldehyde 1-(3-nitro-2-pyridyl)hydrazone
CID 9580624
2-methyl-4-[(E)-[(3-nitro-2-pyridinyl)hydrazinylidene]methyl]benzene-1,3-diol
CID 135443097
2,6-dimethoxy-4-{(E)-[2-(5-nitropyridin-2-yl)hydrazinylidene]methyl}phenol
CID 135642811
3-[(Pyridin-2-ylhydrazinylidene)methyl]phenol
CID 263872
4-[[(5-Nitro-2-pyridinyl)hydrazinylidene]methyl]benzene-1,3-diol
CID 4356262
Veratraldehyde, (5-nitro-2-pyridyl)hydrazone
CID 6058184
1-Naphthaldehyde, 2-hydroxy-, (5-nitro-2-pyridyl)hydrazone
CID 135408599
Salicylaldehyde, 5-bromo-, (5-nitro-2-pyridyl)hydrazone
CID 135408600
Salicylaldehyde, 5-chloro-, (5-nitro-2-pyridyl)hydrazone
CID 135538372
Salicylaldehyde, (5-nitro-2-pyridyl)hydrazone
CID 135538374
N-[(4-methoxyphenyl)methylideneamino]-5-nitropyridin-2-amine
CID 95903

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol?
The IUPAC name of 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol (CID 5356182) is 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol.
What is the SMILES notation for 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol?
The canonical SMILES for 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol is O=[N+]([O-])c1ccc(N/N=C\c2cccc(O)c2)nc1.
What is the InChIKey of 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol?
The InChIKey is OJVHJJXXKPNJMP-AUWJEWJLSA-N. The full InChI is InChI=1S/C12H10N4O3/c17-11-3-1-2-9(6-11)7-14-15-12-5-4-10(8-13-12)16(18)19/h1-8,17H,(H,13,15)/b14-7-.
What are the key properties of 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol?
3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol has a molecular weight of 258.24 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenol is sourced from PubChem (CID 5356182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).