2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol

C6H12N2O2 — CID 141226662

IUPAC2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol
SMILESCC(N=CCO)N=CCO
InChIInChI=1S/C6H12N2O2/c1-6(7-2-4-9)8-3-5-10/h2-3,6,9-10H,4-5H2,1H3
InChIKeyFZEQAIZVSOVBGY-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.54
Rot. Bonds4

About 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol

2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol (PubChem CID 141226662) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol.

Molecular Properties

Compound Name2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol
PubChem CID141226662
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol
SMILESCC(N=CCO)N=CCO
InChIInChI=1S/C6H12N2O2/c1-6(7-2-4-9)8-3-5-10/h2-3,6,9-10H,4-5H2,1H3
InChIKeyFZEQAIZVSOVBGY-UHFFFAOYSA-N
XLogP-0.54
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(2E,5E)-3,7-dimethylocta-2,5-dien-1-ol
CID 152758183
(E)-3,5-dimethylhex-2-en-1-ol
CID 13415310
(E)-4-methylpent-2-en-1-ol
CID 5362786
5-methylhex-2-en-1-ol
CID 12538351
CID 131872176
CID 131872176
2-methylpropan-1-ol;zinc
CID 151745482
azane;tris(2-methylpropan-1-ol)
CID 175819145
2-methylpropan-1-ol;zirconium(3+)
CID 150803706
lanthanum;tris(2-methylpropan-1-ol)
CID 140708551
tris(2-methylpropan-1-ol);titanium
CID 87503095
3-methyl-N-(3-methylbutylideneamino)butan-1-imine
CID 73166085
N-butan-2-ylpropan-1-imine;ethane
CID 143076356

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol?
The IUPAC name of 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol (CID 141226662) is 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol.
What is the SMILES notation for 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol?
The canonical SMILES for 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol is CC(N=CCO)N=CCO.
What is the InChIKey of 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol?
The InChIKey is FZEQAIZVSOVBGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-6(7-2-4-9)8-3-5-10/h2-3,6,9-10H,4-5H2,1H3.
What are the key properties of 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol?
2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol has a molecular weight of 144.17 g/mol, XLogP of -0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-hydroxyethylideneamino)ethylimino]ethanol is sourced from PubChem (CID 141226662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).