N'-acetyl-2-phenoxypropanehydrazide

C11H14N2O3 — CID 43011734

IUPACN'-acetyl-2-phenoxypropanehydrazide
SMILESCC(=O)NNC(=O)C(C)Oc1ccccc1
InChIInChI=1S/C11H14N2O3/c1-8(11(15)13-12-9(2)14)16-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,14)(H,13,15)
InChIKeyIFZRKMCUPGNWKB-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.62
Rot. Bonds3

About N'-acetyl-2-phenoxypropanehydrazide

N'-acetyl-2-phenoxypropanehydrazide (PubChem CID 43011734) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is N'-acetyl-2-phenoxypropanehydrazide.

Molecular Properties

Compound NameN'-acetyl-2-phenoxypropanehydrazide
PubChem CID43011734
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC NameN'-acetyl-2-phenoxypropanehydrazide
SMILESCC(=O)NNC(=O)C(C)Oc1ccccc1
InChIInChI=1S/C11H14N2O3/c1-8(11(15)13-12-9(2)14)16-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,14)(H,13,15)
InChIKeyIFZRKMCUPGNWKB-UHFFFAOYSA-N
XLogP0.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-phenoxypropanehydrazide?
The IUPAC name of N'-acetyl-2-phenoxypropanehydrazide (CID 43011734) is N'-acetyl-2-phenoxypropanehydrazide.
What is the SMILES notation for N'-acetyl-2-phenoxypropanehydrazide?
The canonical SMILES for N'-acetyl-2-phenoxypropanehydrazide is CC(=O)NNC(=O)C(C)Oc1ccccc1.
What is the InChIKey of N'-acetyl-2-phenoxypropanehydrazide?
The InChIKey is IFZRKMCUPGNWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-8(11(15)13-12-9(2)14)16-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,14)(H,13,15).
What are the key properties of N'-acetyl-2-phenoxypropanehydrazide?
N'-acetyl-2-phenoxypropanehydrazide has a molecular weight of 222.24 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-phenoxypropanehydrazide is sourced from PubChem (CID 43011734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).