2-(3-benzylphenoxy)acetohydrazide

C15H16N2O2 — CID 154999713

IUPAC2-(3-benzylphenoxy)acetohydrazide
SMILESNNC(=O)COc1cccc(Cc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-17-15(18)11-19-14-8-4-7-13(10-14)9-12-5-2-1-3-6-12/h1-8,10H,9,11,16H2,(H,17,18)
InChIKeyYPILFECXAKZWFN-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.65
Rot. Bonds5

About 2-(3-benzylphenoxy)acetohydrazide

2-(3-benzylphenoxy)acetohydrazide (PubChem CID 154999713) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(3-benzylphenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(3-benzylphenoxy)acetohydrazide
PubChem CID154999713
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-(3-benzylphenoxy)acetohydrazide
SMILESNNC(=O)COc1cccc(Cc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-17-15(18)11-19-14-8-4-7-13(10-14)9-12-5-2-1-3-6-12/h1-8,10H,9,11,16H2,(H,17,18)
InChIKeyYPILFECXAKZWFN-UHFFFAOYSA-N
XLogP1.65
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.65
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

3-(2-hydrazinyl-2-oxoethoxy)benzohydrazide
CID 6420585
2-(4-phenoxyphenoxy)acetohydrazide
CID 873173
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670
1-benzyl-3-(fluoromethoxy)benzene
CID 173286107
2-[3-(aminomethyl)phenoxy]-N-(4-phenoxyphenyl)acetamide
CID 46741579
N-(2-aminoethyl)-2-(4-benzylphenoxy)acetamide
CID 62275392
3-(3-ethylphenoxy)propanehydrazide
CID 63575003
2-[3-(methylaminomethyl)phenoxy]-N-propylacetamide
CID 43278288
N-methyl-2-[3-(propylaminomethyl)phenoxy]acetamide
CID 43278420
N'-[2-(2-benzylphenoxy)acetyl]-2-(3-methylphenoxy)acetohydrazide
CID 7943215
2-(3-ethylphenoxy)ethyl 2-[(2-phenoxyacetyl)amino]acetate
CID 55303914
N-benzyl-2-(3-ethoxyphenoxy)acetamide
CID 112977703

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzylphenoxy)acetohydrazide?
The IUPAC name of 2-(3-benzylphenoxy)acetohydrazide (CID 154999713) is 2-(3-benzylphenoxy)acetohydrazide.
What is the SMILES notation for 2-(3-benzylphenoxy)acetohydrazide?
The canonical SMILES for 2-(3-benzylphenoxy)acetohydrazide is NNC(=O)COc1cccc(Cc2ccccc2)c1.
What is the InChIKey of 2-(3-benzylphenoxy)acetohydrazide?
The InChIKey is YPILFECXAKZWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c16-17-15(18)11-19-14-8-4-7-13(10-14)9-12-5-2-1-3-6-12/h1-8,10H,9,11,16H2,(H,17,18).
What are the key properties of 2-(3-benzylphenoxy)acetohydrazide?
2-(3-benzylphenoxy)acetohydrazide has a molecular weight of 256.31 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzylphenoxy)acetohydrazide is sourced from PubChem (CID 154999713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).