2-aminoethanol

C4H14N2O2 — CID 87375731

IUPAC2-aminoethanol
SMILESNCCO.NCCO
InChIInChI=1S/2C2H7NO/c2*3-1-2-4/h2*4H,1-3H2
InChIKeyBSIUFWMDOOFBSP-UHFFFAOYSA-N
MW122.17 g/mol
LogP-2.13
Rot. Bonds2

About 2-aminoethanol

2-aminoethanol (PubChem CID 87375731) has the molecular formula C4H14N2O2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 2-aminoethanol.

Molecular Properties

Compound Name2-aminoethanol
PubChem CID87375731
Molecular FormulaC4H14N2O2
Molecular Weight122.17 g/mol
Exact Mass122.11
IUPAC Name2-aminoethanol
SMILESNCCO.NCCO
InChIInChI=1S/2C2H7NO/c2*3-1-2-4/h2*4H,1-3H2
InChIKeyBSIUFWMDOOFBSP-UHFFFAOYSA-N
XLogP-2.13
TPSA92.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 5-2.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-(15N)azanylethanol
CID 10329242
2-aminoethanol
CID 159229127
sodium 2-aminoethanol
CID 18941740
2-amino(113C)ethanol;hydrochloride
CID 13000307
CID 162010675
CID 162010675
lithium;2-aminoethanol;chloride
CID 174961548
CID 88757249
CID 88757249
2-aminoethanol;azane;trihydrate
CID 173457849
2-aminoethanol;platinum;hexahydroxide
CID 14818797
2-aminoethanol;ethane
CID 90703907
2-aminoethanol;butane-1,4-diol
CID 135347340
2-aminoethanol;carbanide;platinum(4+);trihydroxide
CID 173270810

Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol?
The IUPAC name of 2-aminoethanol (CID 87375731) is 2-aminoethanol.
What is the SMILES notation for 2-aminoethanol?
The canonical SMILES for 2-aminoethanol is NCCO.NCCO.
What is the InChIKey of 2-aminoethanol?
The InChIKey is BSIUFWMDOOFBSP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H7NO/c2*3-1-2-4/h2*4H,1-3H2.
What are the key properties of 2-aminoethanol?
2-aminoethanol has a molecular weight of 122.17 g/mol, XLogP of -2.13, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol is sourced from PubChem (CID 87375731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).