1-(2-aminoethoxy)-2-(dimethylamino)ethanol

C6H16N2O2 — CID 18764612

IUPAC1-(2-aminoethoxy)-2-(dimethylamino)ethanol
SMILESCN(C)CC(O)OCCN
InChIInChI=1S/C6H16N2O2/c1-8(2)5-6(9)10-4-3-7/h6,9H,3-5,7H2,1-2H3
InChIKeyHZQDLJITAYRZDB-UHFFFAOYSA-N
MW148.21 g/mol
LogP-1.16
Rot. Bonds5

About 1-(2-aminoethoxy)-2-(dimethylamino)ethanol

1-(2-aminoethoxy)-2-(dimethylamino)ethanol (PubChem CID 18764612) has the molecular formula C6H16N2O2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 1-(2-aminoethoxy)-2-(dimethylamino)ethanol.

Molecular Properties

Compound Name1-(2-aminoethoxy)-2-(dimethylamino)ethanol
PubChem CID18764612
Molecular FormulaC6H16N2O2
Molecular Weight148.21 g/mol
Exact Mass148.12
IUPAC Name1-(2-aminoethoxy)-2-(dimethylamino)ethanol
SMILESCN(C)CC(O)OCCN
InChIInChI=1S/C6H16N2O2/c1-8(2)5-6(9)10-4-3-7/h6,9H,3-5,7H2,1-2H3
InChIKeyHZQDLJITAYRZDB-UHFFFAOYSA-N
XLogP-1.16
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethoxy)-2-(dimethylamino)ethanol?
The IUPAC name of 1-(2-aminoethoxy)-2-(dimethylamino)ethanol (CID 18764612) is 1-(2-aminoethoxy)-2-(dimethylamino)ethanol.
What is the SMILES notation for 1-(2-aminoethoxy)-2-(dimethylamino)ethanol?
The canonical SMILES for 1-(2-aminoethoxy)-2-(dimethylamino)ethanol is CN(C)CC(O)OCCN.
What is the InChIKey of 1-(2-aminoethoxy)-2-(dimethylamino)ethanol?
The InChIKey is HZQDLJITAYRZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O2/c1-8(2)5-6(9)10-4-3-7/h6,9H,3-5,7H2,1-2H3.
What are the key properties of 1-(2-aminoethoxy)-2-(dimethylamino)ethanol?
1-(2-aminoethoxy)-2-(dimethylamino)ethanol has a molecular weight of 148.21 g/mol, XLogP of -1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethoxy)-2-(dimethylamino)ethanol is sourced from PubChem (CID 18764612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).