2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide

C12H18N2O3 — CID 116846735

IUPAC2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide
SMILESCCOc1ccc(COCC(=O)NNC)cc1
InChIInChI=1S/C12H18N2O3/c1-3-17-11-6-4-10(5-7-11)8-16-9-12(15)14-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15)
InChIKeyDJFDWETZAGZJGT-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.85
Rot. Bonds7

About 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide

2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide (PubChem CID 116846735) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide.

Molecular Properties

Compound Name2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide
PubChem CID116846735
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide
SMILESCCOc1ccc(COCC(=O)NNC)cc1
InChIInChI=1S/C12H18N2O3/c1-3-17-11-6-4-10(5-7-11)8-16-9-12(15)14-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15)
InChIKeyDJFDWETZAGZJGT-UHFFFAOYSA-N
XLogP0.85
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(4-ethoxyphenyl)-N'-methylpropanehydrazide
CID 116846343
1-ethoxy-4-[(4-ethoxyphenyl)methoxymethyl]benzene
CID 123874930
N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
CID 116846698
2-[(3,4-dimethylphenyl)methoxy]-N'-methylacetohydrazide
CID 116846700
2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide
CID 101189832
N-[(4-ethoxyphenyl)methyl]-3-oxobutanamide
CID 115176377
2-(4-chlorophenyl)-N'-[2-(4-ethoxyphenoxy)acetyl]acetohydrazide
CID 31467291
2-(4-tert-butylphenoxy)-N'-methylacetohydrazide
CID 116820676
N,N'-bis[(4-ethoxyphenyl)methyl]oxamide
CID 125144939
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873
N-[(4-ethoxyphenyl)methyl]-2-(methylamino)acetamide;hydrochloride
CID 119714333
2-[(4-ethoxyphenyl)methylamino]oxyacetamide
CID 112673119

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide?
The IUPAC name of 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide (CID 116846735) is 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide.
What is the SMILES notation for 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide?
The canonical SMILES for 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide is CCOc1ccc(COCC(=O)NNC)cc1.
What is the InChIKey of 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide?
The InChIKey is DJFDWETZAGZJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-3-17-11-6-4-10(5-7-11)8-16-9-12(15)14-13-2/h4-7,13H,3,8-9H2,1-2H3,(H,14,15).
What are the key properties of 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide?
2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide has a molecular weight of 238.29 g/mol, XLogP of 0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide is sourced from PubChem (CID 116846735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).