2-phenoxypyridine-3-carbohydrazide

C12H11N3O2 — CID 2797685

IUPAC2-phenoxypyridine-3-carbohydrazide
SMILESNNC(=O)c1cccnc1Oc1ccccc1
InChIInChI=1S/C12H11N3O2/c13-15-11(16)10-7-4-8-14-12(10)17-9-5-2-1-3-6-9/h1-8H,13H2,(H,15,16)
InChIKeyLZIVTMKZXYGBTB-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.48
Rot. Bonds3

About 2-phenoxypyridine-3-carbohydrazide

2-phenoxypyridine-3-carbohydrazide (PubChem CID 2797685) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is 2-phenoxypyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-phenoxypyridine-3-carbohydrazide
PubChem CID2797685
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC Name2-phenoxypyridine-3-carbohydrazide
SMILESNNC(=O)c1cccnc1Oc1ccccc1
InChIInChI=1S/C12H11N3O2/c13-15-11(16)10-7-4-8-14-12(10)17-9-5-2-1-3-6-9/h1-8H,13H2,(H,15,16)
InChIKeyLZIVTMKZXYGBTB-UHFFFAOYSA-N
XLogP1.48
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.48
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-phenoxypyridine-3-carbohydrazide?
The IUPAC name of 2-phenoxypyridine-3-carbohydrazide (CID 2797685) is 2-phenoxypyridine-3-carbohydrazide.
What is the SMILES notation for 2-phenoxypyridine-3-carbohydrazide?
The canonical SMILES for 2-phenoxypyridine-3-carbohydrazide is NNC(=O)c1cccnc1Oc1ccccc1.
What is the InChIKey of 2-phenoxypyridine-3-carbohydrazide?
The InChIKey is LZIVTMKZXYGBTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c13-15-11(16)10-7-4-8-14-12(10)17-9-5-2-1-3-6-9/h1-8H,13H2,(H,15,16).
What are the key properties of 2-phenoxypyridine-3-carbohydrazide?
2-phenoxypyridine-3-carbohydrazide has a molecular weight of 229.24 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxypyridine-3-carbohydrazide is sourced from PubChem (CID 2797685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).