3-(3-ethylphenoxy)propanehydrazide

C11H16N2O2 — CID 63575003

IUPAC3-(3-ethylphenoxy)propanehydrazide
SMILESCCc1cccc(OCCC(=O)NN)c1
InChIInChI=1S/C11H16N2O2/c1-2-9-4-3-5-10(8-9)15-7-6-11(14)13-12/h3-5,8H,2,6-7,12H2,1H3,(H,13,14)
InChIKeyJLWWJWWWBZTXRP-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.01
Rot. Bonds5

About 3-(3-ethylphenoxy)propanehydrazide

3-(3-ethylphenoxy)propanehydrazide (PubChem CID 63575003) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-(3-ethylphenoxy)propanehydrazide.

Molecular Properties

Compound Name3-(3-ethylphenoxy)propanehydrazide
PubChem CID63575003
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-(3-ethylphenoxy)propanehydrazide
SMILESCCc1cccc(OCCC(=O)NN)c1
InChIInChI=1S/C11H16N2O2/c1-2-9-4-3-5-10(8-9)15-7-6-11(14)13-12/h3-5,8H,2,6-7,12H2,1H3,(H,13,14)
InChIKeyJLWWJWWWBZTXRP-UHFFFAOYSA-N
XLogP1.01
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 ≤ 51.01
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-(3-ethylphenoxy)-N-methylpropanamide
CID 64763281
4-(3-ethylphenoxy)butanamide
CID 82040637
7-(3-ethylphenoxy)-N-hydroxyheptanamide
CID 39364757
3-(3-ethylphenoxy)-1-phenylpropan-1-one
CID 116692020
3-[3-(aminomethyl)phenoxy]-N-methylpropanamide
CID 62324722
propyl 2-(3-ethylphenoxy)acetate
CID 71628037
3-(4-propoxyphenoxy)propanehydrazide
CID 63576064
4-O-[2-(3-ethylphenoxy)ethyl] 1-O-methyl benzene-1,4-dicarboxylate
CID 55308189
3-[3-(ethylaminomethyl)phenoxy]-N-methylpropanamide
CID 62324546
3-[3-(aminomethyl)phenoxy]-N-propan-2-ylpropanamide
CID 62625154
3-[3-(2-aminobutyl)phenoxy]-N-methylpropanamide
CID 62325770
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylphenoxy)propanehydrazide?
The IUPAC name of 3-(3-ethylphenoxy)propanehydrazide (CID 63575003) is 3-(3-ethylphenoxy)propanehydrazide.
What is the SMILES notation for 3-(3-ethylphenoxy)propanehydrazide?
The canonical SMILES for 3-(3-ethylphenoxy)propanehydrazide is CCc1cccc(OCCC(=O)NN)c1.
What is the InChIKey of 3-(3-ethylphenoxy)propanehydrazide?
The InChIKey is JLWWJWWWBZTXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-9-4-3-5-10(8-9)15-7-6-11(14)13-12/h3-5,8H,2,6-7,12H2,1H3,(H,13,14).
What are the key properties of 3-(3-ethylphenoxy)propanehydrazide?
3-(3-ethylphenoxy)propanehydrazide has a molecular weight of 208.26 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylphenoxy)propanehydrazide is sourced from PubChem (CID 63575003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).