2-(3-ethylphenoxy)-N-methylacetohydrazide

C11H16N2O2 — CID 116820496

IUPAC2-(3-ethylphenoxy)-N-methylacetohydrazide
SMILESCCc1cccc(OCC(=O)N(C)N)c1
InChIInChI=1S/C11H16N2O2/c1-3-9-5-4-6-10(7-9)15-8-11(14)13(2)12/h4-7H,3,8,12H2,1-2H3
InChIKeySAJWQICRLYOABY-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.96
Rot. Bonds4

About 2-(3-ethylphenoxy)-N-methylacetohydrazide

2-(3-ethylphenoxy)-N-methylacetohydrazide (PubChem CID 116820496) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-methylacetohydrazide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-methylacetohydrazide
PubChem CID116820496
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(3-ethylphenoxy)-N-methylacetohydrazide
SMILESCCc1cccc(OCC(=O)N(C)N)c1
InChIInChI=1S/C11H16N2O2/c1-3-9-5-4-6-10(7-9)15-8-11(14)13(2)12/h4-7H,3,8,12H2,1-2H3
InChIKeySAJWQICRLYOABY-UHFFFAOYSA-N
XLogP0.96
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.96
H-Bond Donors ≤ 51
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'}

Analyze 2-(3-ethylphenoxy)-N-methylacetohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-ethoxyphenoxy)-N-methylacetohydrazide
CID 116820503
2-[[2-(3-ethylphenoxy)acetyl]-methylamino]acetic acid
CID 43092155
2-(4-ethylphenoxy)-N-methylacetohydrazide
CID 116820497
propyl 2-(3-ethylphenoxy)acetate
CID 71628037
2-[ethyl-[2-(3-ethylphenoxy)acetyl]amino]acetic acid
CID 54900937
N-ethyl-2-(3-ethylphenoxy)-N-(2-hydroxyethyl)acetamide
CID 60653414
4-[[2-(3-ethylphenoxy)acetyl]-methylamino]butanoic acid
CID 43240334
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670
N'-acetyl-2-(3-ethylphenoxy)acetohydrazide
CID 43011736
2-[3-[2-[ethyl(methyl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 61398190
4-(3-ethylphenoxy)butanamide
CID 82040637
3-(3-ethylphenoxy)propanehydrazide
CID 63575003

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-methylacetohydrazide?
The IUPAC name of 2-(3-ethylphenoxy)-N-methylacetohydrazide (CID 116820496) is 2-(3-ethylphenoxy)-N-methylacetohydrazide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-methylacetohydrazide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-methylacetohydrazide is CCc1cccc(OCC(=O)N(C)N)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-methylacetohydrazide?
The InChIKey is SAJWQICRLYOABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-9-5-4-6-10(7-9)15-8-11(14)13(2)12/h4-7H,3,8,12H2,1-2H3.
What are the key properties of 2-(3-ethylphenoxy)-N-methylacetohydrazide?
2-(3-ethylphenoxy)-N-methylacetohydrazide has a molecular weight of 208.26 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-methylacetohydrazide is sourced from PubChem (CID 116820496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).