2-(2-cyanophenoxy)acetohydrazide

C9H9N3O2 — CID 552149

IUPAC2-(2-cyanophenoxy)acetohydrazide
SMILESN#Cc1ccccc1OCC(=O)NN
InChIInChI=1S/C9H9N3O2/c10-5-7-3-1-2-4-8(7)14-6-9(13)12-11/h1-4H,6,11H2,(H,12,13)
InChIKeyHIANUIPKYSYZAG-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.07
Rot. Bonds3

About 2-(2-cyanophenoxy)acetohydrazide

2-(2-cyanophenoxy)acetohydrazide (PubChem CID 552149) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)acetohydrazide
PubChem CID552149
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name2-(2-cyanophenoxy)acetohydrazide
SMILESN#Cc1ccccc1OCC(=O)NN
InChIInChI=1S/C9H9N3O2/c10-5-7-3-1-2-4-8(7)14-6-9(13)12-11/h1-4H,6,11H2,(H,12,13)
InChIKeyHIANUIPKYSYZAG-UHFFFAOYSA-N
XLogP-0.07
TPSA88.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)acetohydrazide?
The IUPAC name of 2-(2-cyanophenoxy)acetohydrazide (CID 552149) is 2-(2-cyanophenoxy)acetohydrazide.
What is the SMILES notation for 2-(2-cyanophenoxy)acetohydrazide?
The canonical SMILES for 2-(2-cyanophenoxy)acetohydrazide is N#Cc1ccccc1OCC(=O)NN.
What is the InChIKey of 2-(2-cyanophenoxy)acetohydrazide?
The InChIKey is HIANUIPKYSYZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-5-7-3-1-2-4-8(7)14-6-9(13)12-11/h1-4H,6,11H2,(H,12,13).
What are the key properties of 2-(2-cyanophenoxy)acetohydrazide?
2-(2-cyanophenoxy)acetohydrazide has a molecular weight of 191.19 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)acetohydrazide is sourced from PubChem (CID 552149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).