N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide

C16H24N2O4 — CID 78775327

IUPACN'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide
SMILESCCOc1ccccc1OCC(=O)NNC(=O)C(CC)CC
InChIInChI=1S/C16H24N2O4/c1-4-12(5-2)16(20)18-17-15(19)11-22-14-10-8-7-9-13(14)21-6-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyPMHNCGOCPLPLAF-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.05
Rot. Bonds8

About N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide

N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide (PubChem CID 78775327) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide.

Molecular Properties

Compound NameN'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide
PubChem CID78775327
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC NameN'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide
SMILESCCOc1ccccc1OCC(=O)NNC(=O)C(CC)CC
InChIInChI=1S/C16H24N2O4/c1-4-12(5-2)16(20)18-17-15(19)11-22-14-10-8-7-9-13(14)21-6-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyPMHNCGOCPLPLAF-UHFFFAOYSA-N
XLogP2.05
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.05
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

N'-[2-(2-ethoxyphenoxy)acetyl]-2-methylsulfanylpropanehydrazide
CID 55684408
N'-[2-(2-ethoxyphenoxy)acetyl]-2-iodobenzohydrazide
CID 55334001
N'-[2-(2-ethoxyphenoxy)acetyl]-2-(4-fluorophenyl)acetohydrazide
CID 26656633
N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 18159247
N'-[2-(2-ethoxyphenoxy)acetyl]-4-methylbenzohydrazide
CID 7918380
benzyl N-[(2S)-1-[2-[2-(2-ethoxyphenoxy)acetyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate
CID 55944322
2-(2-butan-2-ylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]propanehydrazide
CID 17130025
N-cyano-2-(2-ethoxyphenoxy)acetamide
CID 79194263
2-(2-ethoxyphenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 731794
N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyphenoxy)acetamide
CID 7941491
N'-[2-(2-ethoxyphenoxy)acetyl]thiophene-2-carbohydrazide
CID 24536023
2-(2-ethoxyphenoxy)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82726093

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide?
The IUPAC name of N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide (CID 78775327) is N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide.
What is the SMILES notation for N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide?
The canonical SMILES for N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide is CCOc1ccccc1OCC(=O)NNC(=O)C(CC)CC.
What is the InChIKey of N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide?
The InChIKey is PMHNCGOCPLPLAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-4-12(5-2)16(20)18-17-15(19)11-22-14-10-8-7-9-13(14)21-6-3/h7-10,12H,4-6,11H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide?
N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide has a molecular weight of 308.38 g/mol, XLogP of 2.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide is sourced from PubChem (CID 78775327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).