1-(1-aminoethoxy)ethanol;azane

C4H14N2O2 — CID 19692086

IUPAC1-(1-aminoethoxy)ethanol;azane
SMILESCC(N)OC(C)O.N
InChIInChI=1S/C4H11NO2.H3N/c1-3(5)7-4(2)6;/h3-4,6H,5H2,1-2H3;1H3
InChIKeyOGCOQRWRNLZFPF-UHFFFAOYSA-N
MW122.17 g/mol
LogP-0.19
Rot. Bonds2

About 1-(1-aminoethoxy)ethanol;azane

1-(1-aminoethoxy)ethanol;azane (PubChem CID 19692086) has the molecular formula C4H14N2O2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 1-(1-aminoethoxy)ethanol;azane.

Molecular Properties

Compound Name1-(1-aminoethoxy)ethanol;azane
PubChem CID19692086
Molecular FormulaC4H14N2O2
Molecular Weight122.17 g/mol
Exact Mass122.11
IUPAC Name1-(1-aminoethoxy)ethanol;azane
SMILESCC(N)OC(C)O.N
InChIInChI=1S/C4H11NO2.H3N/c1-3(5)7-4(2)6;/h3-4,6H,5H2,1-2H3;1H3
InChIKeyOGCOQRWRNLZFPF-UHFFFAOYSA-N
XLogP-0.19
TPSA90.48 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(1-aminoethoxy)ethanol;azane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminoethoxy)ethanol;azane?
The IUPAC name of 1-(1-aminoethoxy)ethanol;azane (CID 19692086) is 1-(1-aminoethoxy)ethanol;azane.
What is the SMILES notation for 1-(1-aminoethoxy)ethanol;azane?
The canonical SMILES for 1-(1-aminoethoxy)ethanol;azane is CC(N)OC(C)O.N.
What is the InChIKey of 1-(1-aminoethoxy)ethanol;azane?
The InChIKey is OGCOQRWRNLZFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO2.H3N/c1-3(5)7-4(2)6;/h3-4,6H,5H2,1-2H3;1H3.
What are the key properties of 1-(1-aminoethoxy)ethanol;azane?
1-(1-aminoethoxy)ethanol;azane has a molecular weight of 122.17 g/mol, XLogP of -0.19, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminoethoxy)ethanol;azane is sourced from PubChem (CID 19692086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).