2-(2-hexoxyethoxy)ethanamine

C10H23NO2 — CID 21183648

IUPAC2-(2-hexoxyethoxy)ethanamine
SMILESCCCCCCOCCOCCN
InChIInChI=1S/C10H23NO2/c1-2-3-4-5-7-12-9-10-13-8-6-11/h2-11H2,1H3
InChIKeyUWGKBPIURBIGKJ-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.56
Rot. Bonds10

About 2-(2-hexoxyethoxy)ethanamine

2-(2-hexoxyethoxy)ethanamine (PubChem CID 21183648) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-(2-hexoxyethoxy)ethanamine.

Molecular Properties

Compound Name2-(2-hexoxyethoxy)ethanamine
PubChem CID21183648
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name2-(2-hexoxyethoxy)ethanamine
SMILESCCCCCCOCCOCCN
InChIInChI=1S/C10H23NO2/c1-2-3-4-5-7-12-9-10-13-8-6-11/h2-11H2,1H3
InChIKeyUWGKBPIURBIGKJ-UHFFFAOYSA-N
XLogP1.56
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hexoxyethoxy)ethanamine?
The IUPAC name of 2-(2-hexoxyethoxy)ethanamine (CID 21183648) is 2-(2-hexoxyethoxy)ethanamine.
What is the SMILES notation for 2-(2-hexoxyethoxy)ethanamine?
The canonical SMILES for 2-(2-hexoxyethoxy)ethanamine is CCCCCCOCCOCCN.
What is the InChIKey of 2-(2-hexoxyethoxy)ethanamine?
The InChIKey is UWGKBPIURBIGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-2-3-4-5-7-12-9-10-13-8-6-11/h2-11H2,1H3.
What are the key properties of 2-(2-hexoxyethoxy)ethanamine?
2-(2-hexoxyethoxy)ethanamine has a molecular weight of 189.30 g/mol, XLogP of 1.56, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hexoxyethoxy)ethanamine is sourced from PubChem (CID 21183648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).