2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide

C13H20N2O3 — CID 107714182

IUPAC2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide
SMILESCCCC(Oc1ccccc1CCO)C(=O)NN
InChIInChI=1S/C13H20N2O3/c1-2-5-12(13(17)15-14)18-11-7-4-3-6-10(11)8-9-16/h3-4,6-7,12,16H,2,5,8-9,14H2,1H3,(H,15,17)
InChIKeyPMEKDJOHVPTPHK-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.76
Rot. Bonds7

About 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide

2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide (PubChem CID 107714182) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide
PubChem CID107714182
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide
SMILESCCCC(Oc1ccccc1CCO)C(=O)NN
InChIInChI=1S/C13H20N2O3/c1-2-5-12(13(17)15-14)18-11-7-4-3-6-10(11)8-9-16/h3-4,6-7,12,16H,2,5,8-9,14H2,1H3,(H,15,17)
InChIKeyPMEKDJOHVPTPHK-UHFFFAOYSA-N
XLogP0.76
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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'}

Analyze 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-[2-(2-hydroxyethyl)phenoxy]pentanoate
CID 107711619
ethyl 2-fluoro-2-[2-(2-hydroxyethyl)phenoxy]acetate
CID 107711553
2-(2-ethylphenoxy)pentanoic acid
CID 83038631
2-fluoro-6-(1-hydrazinyl-1-oxopentan-2-yl)oxybenzamide
CID 83047514
2-naphthalen-2-yloxypentanehydrazide
CID 54792972
2-(2,6-dimethylphenoxy)pentanehydrazide
CID 54792907
ethyl 2-[2-(2-aminopropyl)phenoxy]pentanoate
CID 83049068
2-phenoxypentaneperoxoic acid
CID 18459699
2-[2-(1-phenylethoxy)phenyl]ethanol
CID 107713134
(3S)-3-[2-(2-hydroxyethyl)phenoxy]butanoic acid
CID 107711645
2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 107713094
2-(3,4-difluorophenoxy)pentanehydrazide
CID 83048019

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide?
The IUPAC name of 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide (CID 107714182) is 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide.
What is the SMILES notation for 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide?
The canonical SMILES for 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide is CCCC(Oc1ccccc1CCO)C(=O)NN.
What is the InChIKey of 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide?
The InChIKey is PMEKDJOHVPTPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-2-5-12(13(17)15-14)18-11-7-4-3-6-10(11)8-9-16/h3-4,6-7,12,16H,2,5,8-9,14H2,1H3,(H,15,17).
What are the key properties of 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide?
2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide has a molecular weight of 252.31 g/mol, XLogP of 0.76, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethyl)phenoxy]pentanehydrazide is sourced from PubChem (CID 107714182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).