2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile

C12H10N4O — CID 80918520

IUPAC2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile
SMILESN#Cc1ccccc1Oc1cccc(NN)n1
InChIInChI=1S/C12H10N4O/c13-8-9-4-1-2-5-10(9)17-12-7-3-6-11(15-12)16-14/h1-7H,14H2,(H,15,16)
InChIKeyVONHALLCDZUQGO-UHFFFAOYSA-N
MW226.24 g/mol
LogP2.03
Rot. Bonds3

About 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile

2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile (PubChem CID 80918520) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile.

Molecular Properties

Compound Name2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile
PubChem CID80918520
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile
SMILESN#Cc1ccccc1Oc1cccc(NN)n1
InChIInChI=1S/C12H10N4O/c13-8-9-4-1-2-5-10(9)17-12-7-3-6-11(15-12)16-14/h1-7H,14H2,(H,15,16)
InChIKeyVONHALLCDZUQGO-UHFFFAOYSA-N
XLogP2.03
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]oxybenzonitrile
CID 106776357
2-(4-aminopyrido[3,2-d]pyrimidin-6-yl)oxybenzonitrile
CID 90054807
2-(2-cyanophenoxy)benzonitrile
CID 13435570
2-(2,6-diaminophenoxy)benzonitrile
CID 163217042
2-[6-(methylamino)pyrimidin-4-yl]oxybenzonitrile
CID 80863385
2-[(6-hydrazinyl-2-pyridinyl)-methylamino]benzonitrile
CID 80926117
[6-(4-fluoro-2-nitrophenoxy)-2-pyridinyl]hydrazine
CID 80931175
2-(6-amino-2-methylpyrimidin-4-yl)oxybenzonitrile
CID 80862632
[6-(4-iodophenoxy)-2-pyridinyl]hydrazine
CID 80916365
[6-(2-chloro-4-methylphenoxy)-2-pyridinyl]hydrazine
CID 80930553
[6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine
CID 114677416
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]oxy]benzonitrile
CID 80918439

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile?
The IUPAC name of 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile (CID 80918520) is 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile.
What is the SMILES notation for 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile?
The canonical SMILES for 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile is N#Cc1ccccc1Oc1cccc(NN)n1.
What is the InChIKey of 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile?
The InChIKey is VONHALLCDZUQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c13-8-9-4-1-2-5-10(9)17-12-7-3-6-11(15-12)16-14/h1-7H,14H2,(H,15,16).
What are the key properties of 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile?
2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile has a molecular weight of 226.24 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-2-pyridinyl)oxy]benzonitrile is sourced from PubChem (CID 80918520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).