N'-(3-phenoxypropanoyl)benzohydrazide

C16H16N2O3 — CID 2082175

IUPACN'-(3-phenoxypropanoyl)benzohydrazide
SMILESO=C(CCOc1ccccc1)NNC(=O)c1ccccc1
InChIInChI=1S/C16H16N2O3/c19-15(11-12-21-14-9-5-2-6-10-14)17-18-16(20)13-7-3-1-4-8-13/h1-10H,11-12H2,(H,17,19)(H,18,20)
InChIKeyOCKHBNIOCPMJLI-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.92
Rot. Bonds5

About N'-(3-phenoxypropanoyl)benzohydrazide

N'-(3-phenoxypropanoyl)benzohydrazide (PubChem CID 2082175) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is N'-(3-phenoxypropanoyl)benzohydrazide.

Molecular Properties

Compound NameN'-(3-phenoxypropanoyl)benzohydrazide
PubChem CID2082175
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC NameN'-(3-phenoxypropanoyl)benzohydrazide
SMILESO=C(CCOc1ccccc1)NNC(=O)c1ccccc1
InChIInChI=1S/C16H16N2O3/c19-15(11-12-21-14-9-5-2-6-10-14)17-18-16(20)13-7-3-1-4-8-13/h1-10H,11-12H2,(H,17,19)(H,18,20)
InChIKeyOCKHBNIOCPMJLI-UHFFFAOYSA-N
XLogP1.92
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-(3-phenoxypropanoyl)benzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(3-phenoxypropanoyl)benzohydrazide?
The IUPAC name of N'-(3-phenoxypropanoyl)benzohydrazide (CID 2082175) is N'-(3-phenoxypropanoyl)benzohydrazide.
What is the SMILES notation for N'-(3-phenoxypropanoyl)benzohydrazide?
The canonical SMILES for N'-(3-phenoxypropanoyl)benzohydrazide is O=C(CCOc1ccccc1)NNC(=O)c1ccccc1.
What is the InChIKey of N'-(3-phenoxypropanoyl)benzohydrazide?
The InChIKey is OCKHBNIOCPMJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c19-15(11-12-21-14-9-5-2-6-10-14)17-18-16(20)13-7-3-1-4-8-13/h1-10H,11-12H2,(H,17,19)(H,18,20).
What are the key properties of N'-(3-phenoxypropanoyl)benzohydrazide?
N'-(3-phenoxypropanoyl)benzohydrazide has a molecular weight of 284.32 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-phenoxypropanoyl)benzohydrazide is sourced from PubChem (CID 2082175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).