2-[2-(dodecylamino)ethoxy]ethanol

C16H35NO2 — CID 4546884

IUPAC2-[2-(dodecylamino)ethoxy]ethanol
SMILESCCCCCCCCCCCCNCCOCCO
InChIInChI=1S/C16H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-19-16-14-18/h17-18H,2-16H2,1H3
InChIKeyHAESTAVRTZTMBT-UHFFFAOYSA-N
MW273.46 g/mol
LogP3.51
Rot. Bonds16

About 2-[2-(dodecylamino)ethoxy]ethanol

2-[2-(dodecylamino)ethoxy]ethanol (PubChem CID 4546884) has the molecular formula C16H35NO2 and a molecular weight of 273.46 g/mol. Its IUPAC name is 2-[2-(dodecylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(dodecylamino)ethoxy]ethanol
PubChem CID4546884
Molecular FormulaC16H35NO2
Molecular Weight273.46 g/mol
Exact Mass273.27
IUPAC Name2-[2-(dodecylamino)ethoxy]ethanol
SMILESCCCCCCCCCCCCNCCOCCO
InChIInChI=1S/C16H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-19-16-14-18/h17-18H,2-16H2,1H3
InChIKeyHAESTAVRTZTMBT-UHFFFAOYSA-N
XLogP3.51
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(heptylamino)ethoxy]ethanol
CID 4712323
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(hexadecylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 101188232
N-(2-butoxyethyl)heptan-1-amine
CID 61168932
acetic acid;2-[2-(3-dodecoxypropylamino)ethoxy]ethanol
CID 170851878
2-[3-(2-propoxyethylamino)propoxy]ethanol
CID 106310032
2-[2-(3-propoxypropylamino)ethoxy]ethanol
CID 82944061
hexadecane;2-(2-hydroxyethoxy)ethanol
CID 87490818
2-[2-[2-[2-[2-[2-(propylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 156860733
N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
CID 63492773
2-octadecoxy-N-(2-octadecoxyethyl)ethanamine;hydrochloride
CID 175378194
N-(2-pentoxyethyl)butan-1-amine
CID 54396114
2-heptoxyethanol
CID 23889

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dodecylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(dodecylamino)ethoxy]ethanol (CID 4546884) is 2-[2-(dodecylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(dodecylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(dodecylamino)ethoxy]ethanol is CCCCCCCCCCCCNCCOCCO.
What is the InChIKey of 2-[2-(dodecylamino)ethoxy]ethanol?
The InChIKey is HAESTAVRTZTMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-19-16-14-18/h17-18H,2-16H2,1H3.
What are the key properties of 2-[2-(dodecylamino)ethoxy]ethanol?
2-[2-(dodecylamino)ethoxy]ethanol has a molecular weight of 273.46 g/mol, XLogP of 3.51, 16 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dodecylamino)ethoxy]ethanol is sourced from PubChem (CID 4546884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).