2-ethoxy-N-(2-octoxyethyl)ethanamine

C14H31NO2 — CID 62597622

IUPAC2-ethoxy-N-(2-octoxyethyl)ethanamine
SMILESCCCCCCCCOCCNCCOCC
InChIInChI=1S/C14H31NO2/c1-3-5-6-7-8-9-12-17-14-11-15-10-13-16-4-2/h15H,3-14H2,1-2H3
InChIKeyBHUQUZLQUNKAGP-UHFFFAOYSA-N
MW245.41 g/mol
LogP2.99
Rot. Bonds14

About 2-ethoxy-N-(2-octoxyethyl)ethanamine

2-ethoxy-N-(2-octoxyethyl)ethanamine (PubChem CID 62597622) has the molecular formula C14H31NO2 and a molecular weight of 245.41 g/mol. Its IUPAC name is 2-ethoxy-N-(2-octoxyethyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-(2-octoxyethyl)ethanamine
PubChem CID62597622
Molecular FormulaC14H31NO2
Molecular Weight245.41 g/mol
Exact Mass245.24
IUPAC Name2-ethoxy-N-(2-octoxyethyl)ethanamine
SMILESCCCCCCCCOCCNCCOCC
InChIInChI=1S/C14H31NO2/c1-3-5-6-7-8-9-12-17-14-11-15-10-13-16-4-2/h15H,3-14H2,1-2H3
InChIKeyBHUQUZLQUNKAGP-UHFFFAOYSA-N
XLogP2.99
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 52.99
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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Related Compounds

2-octadecoxy-N-(2-octadecoxyethyl)ethanamine;hydrochloride
CID 175378194
N-(2-undecoxyethyl)propan-1-amine
CID 22091510
N-(2-pentoxyethyl)butan-1-amine
CID 54396114
N-(2-butoxyethyl)heptan-1-amine
CID 61168932
4-ethoxy-N-[2-(2-ethoxyethoxy)ethyl]butan-1-amine
CID 62565012
4-ethoxy-N-(2-ethoxyethyl)butan-1-amine
CID 62565193
1-(3-ethoxypropoxy)tetradecane
CID 91693148
bis(2-octoxy-N-(2-octoxyethyl)ethanamine);oxalic acid
CID 171700708
N-(2-hexoxyethyl)-3-methoxypropan-1-amine
CID 62599714
2-[(Z)-octadec-6-enoxy]-N-[2-[(Z)-octadec-6-enoxy]ethyl]ethanamine
CID 88888828
2-(4-propoxybutoxy)-N-[2-(4-propoxybutoxy)ethyl]ethanamine
CID 87914124
CID 159860963
CID 159860963

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2-octoxyethyl)ethanamine?
The IUPAC name of 2-ethoxy-N-(2-octoxyethyl)ethanamine (CID 62597622) is 2-ethoxy-N-(2-octoxyethyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-(2-octoxyethyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-(2-octoxyethyl)ethanamine is CCCCCCCCOCCNCCOCC.
What is the InChIKey of 2-ethoxy-N-(2-octoxyethyl)ethanamine?
The InChIKey is BHUQUZLQUNKAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO2/c1-3-5-6-7-8-9-12-17-14-11-15-10-13-16-4-2/h15H,3-14H2,1-2H3.
What are the key properties of 2-ethoxy-N-(2-octoxyethyl)ethanamine?
2-ethoxy-N-(2-octoxyethyl)ethanamine has a molecular weight of 245.41 g/mol, XLogP of 2.99, 14 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2-octoxyethyl)ethanamine is sourced from PubChem (CID 62597622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).