N'-(1-phenylethyl)acetohydrazide

C10H14N2O — CID 19875

IUPACN'-(1-phenylethyl)acetohydrazide
SMILESCC(=O)NNC(C)c1ccccc1
InChIInChI=1S/C10H14N2O/c1-8(11-12-9(2)13)10-6-4-3-5-7-10/h3-8,11H,1-2H3,(H,12,13)
InChIKeyXBWREKJBIWXMHG-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.39
Rot. Bonds3

About N'-(1-phenylethyl)acetohydrazide

N'-(1-phenylethyl)acetohydrazide (PubChem CID 19875) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is N'-(1-phenylethyl)acetohydrazide.

Molecular Properties

Compound NameN'-(1-phenylethyl)acetohydrazide
PubChem CID19875
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC NameN'-(1-phenylethyl)acetohydrazide
SMILESCC(=O)NNC(C)c1ccccc1
InChIInChI=1S/C10H14N2O/c1-8(11-12-9(2)13)10-6-4-3-5-7-10/h3-8,11H,1-2H3,(H,12,13)
InChIKeyXBWREKJBIWXMHG-UHFFFAOYSA-N
XLogP1.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-(1-phenylethyl)acetohydrazide 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'-(1-phenylethyl)acetohydrazide?
The IUPAC name of N'-(1-phenylethyl)acetohydrazide (CID 19875) is N'-(1-phenylethyl)acetohydrazide.
What is the SMILES notation for N'-(1-phenylethyl)acetohydrazide?
The canonical SMILES for N'-(1-phenylethyl)acetohydrazide is CC(=O)NNC(C)c1ccccc1.
What is the InChIKey of N'-(1-phenylethyl)acetohydrazide?
The InChIKey is XBWREKJBIWXMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8(11-12-9(2)13)10-6-4-3-5-7-10/h3-8,11H,1-2H3,(H,12,13).
What are the key properties of N'-(1-phenylethyl)acetohydrazide?
N'-(1-phenylethyl)acetohydrazide has a molecular weight of 178.23 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-phenylethyl)acetohydrazide is sourced from PubChem (CID 19875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).