2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine

C13H31N3O5 — CID 155739307

IUPAC2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
SMILESCNCCOCCOCCOCCOCCOCCNN
InChIInChI=1S/C13H31N3O5/c1-15-2-4-17-6-8-19-10-12-21-13-11-20-9-7-18-5-3-16-14/h15-16H,2-14H2,1H3
InChIKeyPMEQUFGDRVASEI-UHFFFAOYSA-N
MW309.41 g/mol
LogP-1.25
Rot. Bonds18

About 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine

2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine (PubChem CID 155739307) has the molecular formula C13H31N3O5 and a molecular weight of 309.41 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine.

Molecular Properties

Compound Name2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
PubChem CID155739307
Molecular FormulaC13H31N3O5
Molecular Weight309.41 g/mol
Exact Mass309.23
IUPAC Name2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine
SMILESCNCCOCCOCCOCCOCCOCCNN
InChIInChI=1S/C13H31N3O5/c1-15-2-4-17-6-8-19-10-12-21-13-11-20-9-7-18-5-3-16-14/h15-16H,2-14H2,1H3
InChIKeyPMEQUFGDRVASEI-UHFFFAOYSA-N
XLogP-1.25
TPSA96.23 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds18
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'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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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The IUPAC name of 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine (CID 155739307) is 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine.
What is the SMILES notation for 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The canonical SMILES for 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine is CNCCOCCOCCOCCOCCOCCNN.
What is the InChIKey of 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
The InChIKey is PMEQUFGDRVASEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31N3O5/c1-15-2-4-17-6-8-19-10-12-21-13-11-20-9-7-18-5-3-16-14/h15-16H,2-14H2,1H3.
What are the key properties of 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine?
2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine has a molecular weight of 309.41 g/mol, XLogP of -1.25, 18 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylethanamine is sourced from PubChem (CID 155739307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).