5-(2-ethoxyphenoxy)pentanehydrazide

C13H20N2O3 — CID 63575982

IUPAC5-(2-ethoxyphenoxy)pentanehydrazide
SMILESCCOc1ccccc1OCCCCC(=O)NN
InChIInChI=1S/C13H20N2O3/c1-2-17-11-7-3-4-8-12(11)18-10-6-5-9-13(16)15-14/h3-4,7-8H,2,5-6,9-10,14H2,1H3,(H,15,16)
InChIKeyNZFXHUIYSAEFSN-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.62
Rot. Bonds8

About 5-(2-ethoxyphenoxy)pentanehydrazide

5-(2-ethoxyphenoxy)pentanehydrazide (PubChem CID 63575982) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 5-(2-ethoxyphenoxy)pentanehydrazide.

Molecular Properties

Compound Name5-(2-ethoxyphenoxy)pentanehydrazide
PubChem CID63575982
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name5-(2-ethoxyphenoxy)pentanehydrazide
SMILESCCOc1ccccc1OCCCCC(=O)NN
InChIInChI=1S/C13H20N2O3/c1-2-17-11-7-3-4-8-12(11)18-10-6-5-9-13(16)15-14/h3-4,7-8H,2,5-6,9-10,14H2,1H3,(H,15,16)
InChIKeyNZFXHUIYSAEFSN-UHFFFAOYSA-N
XLogP1.62
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-(2-ethylphenoxy)pentanehydrazide
CID 63569442
4-(2-methoxyphenoxy)butanehydrazide
CID 63576005
5-(2-prop-1-enylphenoxy)pentanehydrazide
CID 77002054
N-[2-(5-hydrazinyl-5-oxopentoxy)phenyl]acetamide
CID 63576193
4-(2-ethoxyphenoxy)-N-ethylbutanamide
CID 78781225
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
5-(2-nitrophenoxy)pentanehydrazide
CID 63576866
5-(2,3-difluorophenoxy)pentanehydrazide
CID 63569509
N-[(2S)-1-aminopropan-2-yl]-4-(2-ethoxyphenoxy)butanamide
CID 120507806
4-(2,3-dimethylphenoxy)butanehydrazide
CID 63574436
N-benzyl-4-(2-ethoxyphenoxy)butanamide
CID 78774394
N-cyclopentyl-4-(2-ethoxyphenoxy)butanamide
CID 78781833

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyphenoxy)pentanehydrazide?
The IUPAC name of 5-(2-ethoxyphenoxy)pentanehydrazide (CID 63575982) is 5-(2-ethoxyphenoxy)pentanehydrazide.
What is the SMILES notation for 5-(2-ethoxyphenoxy)pentanehydrazide?
The canonical SMILES for 5-(2-ethoxyphenoxy)pentanehydrazide is CCOc1ccccc1OCCCCC(=O)NN.
What is the InChIKey of 5-(2-ethoxyphenoxy)pentanehydrazide?
The InChIKey is NZFXHUIYSAEFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-2-17-11-7-3-4-8-12(11)18-10-6-5-9-13(16)15-14/h3-4,7-8H,2,5-6,9-10,14H2,1H3,(H,15,16).
What are the key properties of 5-(2-ethoxyphenoxy)pentanehydrazide?
5-(2-ethoxyphenoxy)pentanehydrazide has a molecular weight of 252.31 g/mol, XLogP of 1.62, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyphenoxy)pentanehydrazide is sourced from PubChem (CID 63575982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).