2-phenyl-2-propoxyacetohydrazide

C11H16N2O2 — CID 63569629

IUPAC2-phenyl-2-propoxyacetohydrazide
SMILESCCCOC(C(=O)NN)c1ccccc1
InChIInChI=1S/C11H16N2O2/c1-2-8-15-10(11(14)13-12)9-6-4-3-5-7-9/h3-7,10H,2,8,12H2,1H3,(H,13,14)
InChIKeyWMOUZSSEKCERIC-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.14
Rot. Bonds5

About 2-phenyl-2-propoxyacetohydrazide

2-phenyl-2-propoxyacetohydrazide (PubChem CID 63569629) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-phenyl-2-propoxyacetohydrazide.

Molecular Properties

Compound Name2-phenyl-2-propoxyacetohydrazide
PubChem CID63569629
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-phenyl-2-propoxyacetohydrazide
SMILESCCCOC(C(=O)NN)c1ccccc1
InChIInChI=1S/C11H16N2O2/c1-2-8-15-10(11(14)13-12)9-6-4-3-5-7-9/h3-7,10H,2,8,12H2,1H3,(H,13,14)
InChIKeyWMOUZSSEKCERIC-UHFFFAOYSA-N
XLogP1.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

2-(3-methoxypropoxy)-2-phenylacetohydrazide
CID 63587948
2-[3-(2-methoxyethoxy)propoxy]-2-phenylacetohydrazide
CID 103407127
benzyl 2-phenyl-2-propoxyacetate
CID 57015298
(2R)-3-ethoxy-3-oxo-2-[(2-phenyl-2-propoxyacetyl)amino]propane-1-sulfonic acid
CID 89123651
2-phenyl-2-(3-phenylprop-2-enoxy)acetohydrazide
CID 77002066
2-[(2-chlorophenyl)methoxy]-2-phenylacetohydrazide
CID 63588720
methyl (2R)-2-decoxy-2-phenylacetate
CID 45114277
ethyl 2-(3,3-dimethylbutoxy)-2-phenylacetate
CID 106676840
ethyl 2-heptoxy-2-phenylacetate
CID 106676796
ethyl 2-[2-(dimethylamino)ethoxy]-2-phenylacetate
CID 171986152
2-(3,5-dimethylphenoxy)-2-phenylacetohydrazide
CID 63576169
ethyl (2S)-2-[(1S)-2-ethoxy-2-oxo-1-phenylethoxy]-2-phenylacetate
CID 129391195

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-propoxyacetohydrazide?
The IUPAC name of 2-phenyl-2-propoxyacetohydrazide (CID 63569629) is 2-phenyl-2-propoxyacetohydrazide.
What is the SMILES notation for 2-phenyl-2-propoxyacetohydrazide?
The canonical SMILES for 2-phenyl-2-propoxyacetohydrazide is CCCOC(C(=O)NN)c1ccccc1.
What is the InChIKey of 2-phenyl-2-propoxyacetohydrazide?
The InChIKey is WMOUZSSEKCERIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-8-15-10(11(14)13-12)9-6-4-3-5-7-9/h3-7,10H,2,8,12H2,1H3,(H,13,14).
What are the key properties of 2-phenyl-2-propoxyacetohydrazide?
2-phenyl-2-propoxyacetohydrazide has a molecular weight of 208.26 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-propoxyacetohydrazide is sourced from PubChem (CID 63569629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).