1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine

C10H8N4O3 — CID 139214633

IUPAC1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine
SMILESO=[N+]([O-])c1ccc(/N=c2\ccccn2O)nc1
InChIInChI=1S/C10H8N4O3/c15-13-6-2-1-3-10(13)12-9-5-4-8(7-11-9)14(16)17/h1-7,15H/b12-10+
InChIKeyKWKDYWIAYQIVQL-ZRDIBKRKSA-N
MW232.20 g/mol
LogP1.26
Rot. Bonds2

About 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine

1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine (PubChem CID 139214633) has the molecular formula C10H8N4O3 and a molecular weight of 232.20 g/mol. Its IUPAC name is 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine.

Molecular Properties

Compound Name1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine
PubChem CID139214633
Molecular FormulaC10H8N4O3
Molecular Weight232.20 g/mol
Exact Mass232.06
IUPAC Name1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine
SMILESO=[N+]([O-])c1ccc(/N=c2\ccccn2O)nc1
InChIInChI=1S/C10H8N4O3/c15-13-6-2-1-3-10(13)12-9-5-4-8(7-11-9)14(16)17/h1-7,15H/b12-10+
InChIKeyKWKDYWIAYQIVQL-ZRDIBKRKSA-N
XLogP1.26
TPSA93.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', '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

2-(5-nitro-2-pyridinyl)-1-phenylguanidine
CID 100573340
2-isothiocyanato-5-nitropyridine
CID 12866943
1-hydroxy-4-nitro-N-phenylpyridin-2-imine
CID 12577442
N'-(5-nitro-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-carboximidamide
CID 100573733
ethyl-methyl-[(5-nitro-2-pyridinyl)imino]-oxo-λ6-sulfane
CID 125450837
1-(5-nitro-2-pyridinyl)pyridin-2-one
CID 4556084
(3S)-3-methyl-N'-(5-nitro-2-pyridinyl)piperidine-1-carboximidamide
CID 124908137
2-[(5-nitro-2-pyridinyl)diazenyl]naphthalene-1,4-diol
CID 136665588
2-(5-nitro-2-pyridinyl)-2,2-diphenylacetamide
CID 11045860
4-(2-hydroxyethyl)-N'-(5-nitro-2-pyridinyl)piperazine-1-carboximidamide
CID 100573962
(5-nitro-2-pyridinyl)-(phthalazin-1-ylmethyl)diazene
CID 54157550
1-(5-hydroxynaphthalen-1-yl)-2-(5-nitro-2-pyridinyl)guanidine
CID 100573604

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine?
The IUPAC name of 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine (CID 139214633) is 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine.
What is the SMILES notation for 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine?
The canonical SMILES for 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine is O=[N+]([O-])c1ccc(/N=c2\ccccn2O)nc1.
What is the InChIKey of 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine?
The InChIKey is KWKDYWIAYQIVQL-ZRDIBKRKSA-N. The full InChI is InChI=1S/C10H8N4O3/c15-13-6-2-1-3-10(13)12-9-5-4-8(7-11-9)14(16)17/h1-7,15H/b12-10+.
What are the key properties of 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine?
1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine has a molecular weight of 232.20 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(5-nitro-2-pyridinyl)pyridin-2-imine is sourced from PubChem (CID 139214633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).