N'-(2-phenylacetyl)propanehydrazide

C11H14N2O2 — CID 968153

IUPACN'-(2-phenylacetyl)propanehydrazide
SMILESCCC(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-2-10(14)12-13-11(15)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15)
InChIKeyRGMOILFYPZEFOL-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.79
Rot. Bonds3

About N'-(2-phenylacetyl)propanehydrazide

N'-(2-phenylacetyl)propanehydrazide (PubChem CID 968153) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N'-(2-phenylacetyl)propanehydrazide.

Molecular Properties

Compound NameN'-(2-phenylacetyl)propanehydrazide
PubChem CID968153
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN'-(2-phenylacetyl)propanehydrazide
SMILESCCC(=O)NNC(=O)Cc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-2-10(14)12-13-11(15)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15)
InChIKeyRGMOILFYPZEFOL-UHFFFAOYSA-N
XLogP0.79
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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'-(2-phenylacetyl)propanehydrazide?
The IUPAC name of N'-(2-phenylacetyl)propanehydrazide (CID 968153) is N'-(2-phenylacetyl)propanehydrazide.
What is the SMILES notation for N'-(2-phenylacetyl)propanehydrazide?
The canonical SMILES for N'-(2-phenylacetyl)propanehydrazide is CCC(=O)NNC(=O)Cc1ccccc1.
What is the InChIKey of N'-(2-phenylacetyl)propanehydrazide?
The InChIKey is RGMOILFYPZEFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-2-10(14)12-13-11(15)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N'-(2-phenylacetyl)propanehydrazide?
N'-(2-phenylacetyl)propanehydrazide has a molecular weight of 206.24 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-phenylacetyl)propanehydrazide is sourced from PubChem (CID 968153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).