N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide

C14H20N2O5 — CID 17140896

IUPACN'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide
SMILESCCOCC(=O)NNC(=O)C(C)Oc1ccc(OC)cc1
InChIInChI=1S/C14H20N2O5/c1-4-20-9-13(17)15-16-14(18)10(2)21-12-7-5-11(19-3)6-8-12/h5-8,10H,4,9H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyJSVFEFHMKBXVHS-UHFFFAOYSA-N
MW296.32 g/mol
LogP0.65
Rot. Bonds7

About N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide

N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide (PubChem CID 17140896) has the molecular formula C14H20N2O5 and a molecular weight of 296.32 g/mol. Its IUPAC name is N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide.

Molecular Properties

Compound NameN'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide
PubChem CID17140896
Molecular FormulaC14H20N2O5
Molecular Weight296.32 g/mol
Exact Mass296.14
IUPAC NameN'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide
SMILESCCOCC(=O)NNC(=O)C(C)Oc1ccc(OC)cc1
InChIInChI=1S/C14H20N2O5/c1-4-20-9-13(17)15-16-14(18)10(2)21-12-7-5-11(19-3)6-8-12/h5-8,10H,4,9H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyJSVFEFHMKBXVHS-UHFFFAOYSA-N
XLogP0.65
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-ethoxyacetyl)-2-phenoxypropanehydrazide
CID 17140894
2-(4-ethylphenoxy)-N'-[2-(4-methoxyphenyl)acetyl]propanehydrazide
CID 4953442
(2S)-2-(4-ethylphenoxy)-N'-[2-(4-methoxyphenyl)acetyl]propanehydrazide
CID 9237683
(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
CID 42091432
(2S)-N'-[2-(4-methoxyphenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757594
4-[2-[2-(4-methoxyphenoxy)propanoyl]hydrazinyl]-4-oxo-N-phenylbutanamide
CID 4942937
(2R)-2-(4-ethylphenoxy)-N'-[2-(4-ethylphenoxy)acetyl]propanehydrazide
CID 9238118
(2R)-N'-[2-(4-methoxyphenyl)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 7927347
(2R)-N-[(2S)-butan-2-yl]-2-(4-methoxyphenoxy)propanamide
CID 925169
N'-[2-(2-bromo-4-tert-butylphenoxy)acetyl]-2-(4-methoxyphenoxy)propanehydrazide
CID 4943032
N'-(2-indol-1-ylacetyl)-2-(4-methoxyphenoxy)propanehydrazide
CID 17080332
N'-[2-(4-ethoxyphenoxy)propanoyl]-2-phenoxypropanehydrazide
CID 42908805

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide?
The IUPAC name of N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide (CID 17140896) is N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide.
What is the SMILES notation for N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide?
The canonical SMILES for N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide is CCOCC(=O)NNC(=O)C(C)Oc1ccc(OC)cc1.
What is the InChIKey of N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide?
The InChIKey is JSVFEFHMKBXVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5/c1-4-20-9-13(17)15-16-14(18)10(2)21-12-7-5-11(19-3)6-8-12/h5-8,10H,4,9H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide?
N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide has a molecular weight of 296.32 g/mol, XLogP of 0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide is sourced from PubChem (CID 17140896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).