5-(2-ethylphenoxy)pentanehydrazide

C13H20N2O2 — CID 63569442

IUPAC5-(2-ethylphenoxy)pentanehydrazide
SMILESCCc1ccccc1OCCCCC(=O)NN
InChIInChI=1S/C13H20N2O2/c1-2-11-7-3-4-8-12(11)17-10-6-5-9-13(16)15-14/h3-4,7-8H,2,5-6,9-10,14H2,1H3,(H,15,16)
InChIKeyKANILJYIUGUUTR-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.79
Rot. Bonds7

About 5-(2-ethylphenoxy)pentanehydrazide

5-(2-ethylphenoxy)pentanehydrazide (PubChem CID 63569442) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 5-(2-ethylphenoxy)pentanehydrazide.

Molecular Properties

Compound Name5-(2-ethylphenoxy)pentanehydrazide
PubChem CID63569442
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name5-(2-ethylphenoxy)pentanehydrazide
SMILESCCc1ccccc1OCCCCC(=O)NN
InChIInChI=1S/C13H20N2O2/c1-2-11-7-3-4-8-12(11)17-10-6-5-9-13(16)15-14/h3-4,7-8H,2,5-6,9-10,14H2,1H3,(H,15,16)
InChIKeyKANILJYIUGUUTR-UHFFFAOYSA-N
XLogP1.79
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-ethoxyphenoxy)pentanehydrazide
CID 63575982
5-(2-ethylphenoxy)pentanoic acid
CID 43351498
4-(2-ethylphenoxy)butanamide
CID 82040636
N-[2-(5-hydrazinyl-5-oxopentoxy)phenyl]acetamide
CID 63576193
5-(2-prop-1-enylphenoxy)pentanehydrazide
CID 77002054
4-(2-methoxyphenoxy)butanehydrazide
CID 63576005
5-(2-nitrophenoxy)pentanehydrazide
CID 63576866
5-(2,3-difluorophenoxy)pentanehydrazide
CID 63569509
4-(2,3-dimethylphenoxy)butanehydrazide
CID 63574436
5-(2-ethylphenoxy)pentan-1-ol
CID 62228052
1-ethyl-2-heptoxybenzene
CID 22723794
N-(2-aminophenyl)-3-(2-ethylphenoxy)propanamide
CID 43364213

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylphenoxy)pentanehydrazide?
The IUPAC name of 5-(2-ethylphenoxy)pentanehydrazide (CID 63569442) is 5-(2-ethylphenoxy)pentanehydrazide.
What is the SMILES notation for 5-(2-ethylphenoxy)pentanehydrazide?
The canonical SMILES for 5-(2-ethylphenoxy)pentanehydrazide is CCc1ccccc1OCCCCC(=O)NN.
What is the InChIKey of 5-(2-ethylphenoxy)pentanehydrazide?
The InChIKey is KANILJYIUGUUTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-11-7-3-4-8-12(11)17-10-6-5-9-13(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-ethylphenoxy)pentanehydrazide?
5-(2-ethylphenoxy)pentanehydrazide has a molecular weight of 236.31 g/mol, XLogP of 1.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylphenoxy)pentanehydrazide is sourced from PubChem (CID 63569442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).