2-(2-(Ethylamino)ethoxy)ethan-1-ol

C6H15NO2 — CID 28727773

IUPAC2-[2-(ethylamino)ethoxy]ethanol
SMILESCCNCCOCCO
InChIInChI=1S/C6H15NO2/c1-2-7-3-5-9-6-4-8/h7-8H,2-6H2,1H3
InChIKeyCQRNPUSDYPNGDN-UHFFFAOYSA-N
MW133.19 g/mol
LogP-0.70
Rot. Bonds6

About 2-(2-(Ethylamino)ethoxy)ethan-1-ol

2-(2-(Ethylamino)ethoxy)ethan-1-ol (PubChem CID 28727773) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 2-[2-(ethylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-(2-(Ethylamino)ethoxy)ethan-1-ol
PubChem CID28727773
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name2-[2-(ethylamino)ethoxy]ethanol
SMILESCCNCCOCCO
InChIInChI=1S/C6H15NO2/c1-2-7-3-5-9-6-4-8/h7-8H,2-6H2,1H3
InChIKeyCQRNPUSDYPNGDN-UHFFFAOYSA-N
XLogP-0.70
TPSA41.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms9
Complexity50

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 5-0.70
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

Ethanol, 2-[[2-(2-aminoethoxy)ethyl]amino]-
CID 13548365
7,7-Dimethyl-3-oxa-6-azaoctan-1-ol
CID 13643664
Ethanol, 2-2-(2-hydroxyethoxy)ethylamino-
CID 4396106
2-(2-((2-(2-Hydroxyethoxy)ethyl)amino)ethoxy)ethan-1-ol
CID 12212447
Acetamidoethoxyethanol
CID 14143909
2-(2-(Methylamino)ethoxy)ethan-1-ol
CID 15514970
2-(2-{[2-(Dimethylamino)ethyl]amino}ethoxy)ethan-1-ol
CID 50988953
(2-(2-Methoxyethoxy)ethyl)(methyl)amine
CID 12700130
2-((2-Methoxyethyl)amino)ethan-1-ol
CID 20441436
2-{2-[(2-Aminoethyl)(methyl)amino]ethoxy}ethan-1-ol
CID 61350840
Ethyl[2-(2-methoxyethoxy)ethyl]amine
CID 61685148
2-{[2-(2-Methoxyethoxy)ethyl]amino}ethan-1-ol
CID 61848139

Frequently Asked Questions

What is the IUPAC name of 2-(2-(Ethylamino)ethoxy)ethan-1-ol?
The IUPAC name of 2-(2-(Ethylamino)ethoxy)ethan-1-ol (CID 28727773) is 2-[2-(ethylamino)ethoxy]ethanol.
What is the SMILES notation for 2-(2-(Ethylamino)ethoxy)ethan-1-ol?
The canonical SMILES for 2-(2-(Ethylamino)ethoxy)ethan-1-ol is CCNCCOCCO.
What is the InChIKey of 2-(2-(Ethylamino)ethoxy)ethan-1-ol?
The InChIKey is CQRNPUSDYPNGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-2-7-3-5-9-6-4-8/h7-8H,2-6H2,1H3.
What are the key properties of 2-(2-(Ethylamino)ethoxy)ethan-1-ol?
2-(2-(Ethylamino)ethoxy)ethan-1-ol has a molecular weight of 133.19 g/mol, XLogP of -0.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-(Ethylamino)ethoxy)ethan-1-ol is sourced from PubChem (CID 28727773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).