2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide

C12H16N2O3 — CID 764178

IUPAC2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1ccc(OCC(=O)NN)c(OC)c1
InChIInChI=1S/C12H16N2O3/c1-3-4-9-5-6-10(11(7-9)16-2)17-8-12(15)14-13/h3,5-7H,1,4,8,13H2,2H3,(H,14,15)
InChIKeyMFJQLSAUHWBUHB-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.79
Rot. Bonds6

About 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide

2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide (PubChem CID 764178) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
PubChem CID764178
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
SMILESC=CCc1ccc(OCC(=O)NN)c(OC)c1
InChIInChI=1S/C12H16N2O3/c1-3-4-9-5-6-10(11(7-9)16-2)17-8-12(15)14-13/h3,5-7H,1,4,8,13H2,2H3,(H,14,15)
InChIKeyMFJQLSAUHWBUHB-UHFFFAOYSA-N
XLogP0.79
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 78767935
N-cyclohexyl-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 18083381
N-(2-methoxy-5-methylphenyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 26216393
methyl 4,5-dimethoxy-2-[[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]amino]benzoate
CID 26176842
N-benzhydryl-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 7714022
N-(1-amino-4-methylpentan-2-yl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 119586257
methyl 2-[2-(2-methoxy-2-oxoethoxy)-4-prop-2-enylphenoxy]acetate
CID 67377849
N-(2-bromophenyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 26216414
N-(4-ethoxyphenyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 26915649
N-(1-amino-4-methylpentan-2-yl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide;hydrochloride
CID 119586256
N-(5-bromo-2-pyridinyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 78799662
N-(2-acetylphenyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 18168528

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide?
The IUPAC name of 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide (CID 764178) is 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide.
What is the SMILES notation for 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide?
The canonical SMILES for 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide is C=CCc1ccc(OCC(=O)NN)c(OC)c1.
What is the InChIKey of 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide?
The InChIKey is MFJQLSAUHWBUHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-3-4-9-5-6-10(11(7-9)16-2)17-8-12(15)14-13/h3,5-7H,1,4,8,13H2,2H3,(H,14,15).
What are the key properties of 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide?
2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide has a molecular weight of 236.27 g/mol, XLogP of 0.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide is sourced from PubChem (CID 764178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).