2-(2-(18F)fluoroethylamino)ethanol

C4H10FNO — CID 25217747

IUPAC2-(2-(18F)fluoroethylamino)ethanol
SMILESOCCNCC[18F]
InChIInChI=1S/C4H10FNO/c5-1-2-6-3-4-7/h6-7H,1-4H2/i5-1
InChIKeyVUESFNGNRAVVLP-SFIIULIVSA-N
MW106.13 g/mol
LogP-0.46
Rot. Bonds4

About 2-(2-(18F)fluoroethylamino)ethanol

2-(2-(18F)fluoroethylamino)ethanol (PubChem CID 25217747) has the molecular formula C4H10FNO and a molecular weight of 106.13 g/mol. Its IUPAC name is 2-(2-(18F)fluoroethylamino)ethanol.

Molecular Properties

Compound Name2-(2-(18F)fluoroethylamino)ethanol
PubChem CID25217747
Molecular FormulaC4H10FNO
Molecular Weight106.13 g/mol
Exact Mass106.08
IUPAC Name2-(2-(18F)fluoroethylamino)ethanol
SMILESOCCNCC[18F]
InChIInChI=1S/C4H10FNO/c5-1-2-6-3-4-7/h6-7H,1-4H2/i5-1
InChIKeyVUESFNGNRAVVLP-SFIIULIVSA-N
XLogP-0.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.13
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-(18F)fluoroethylamino)ethanol?
The IUPAC name of 2-(2-(18F)fluoroethylamino)ethanol (CID 25217747) is 2-(2-(18F)fluoroethylamino)ethanol.
What is the SMILES notation for 2-(2-(18F)fluoroethylamino)ethanol?
The canonical SMILES for 2-(2-(18F)fluoroethylamino)ethanol is OCCNCC[18F].
What is the InChIKey of 2-(2-(18F)fluoroethylamino)ethanol?
The InChIKey is VUESFNGNRAVVLP-SFIIULIVSA-N. The full InChI is InChI=1S/C4H10FNO/c5-1-2-6-3-4-7/h6-7H,1-4H2/i5-1.
What are the key properties of 2-(2-(18F)fluoroethylamino)ethanol?
2-(2-(18F)fluoroethylamino)ethanol has a molecular weight of 106.13 g/mol, XLogP of -0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-(18F)fluoroethylamino)ethanol is sourced from PubChem (CID 25217747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).