2-(4-fluorophenoxy)ethanamine

C8H10FNO — CID 3135849

IUPAC2-(4-fluorophenoxy)ethanamine
SMILESNCCOc1ccc(F)cc1
InChIInChI=1S/C8H10FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,5-6,10H2
InChIKeyHTMIRIIZZGJJBK-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.16
Rot. Bonds3

About 2-(4-fluorophenoxy)ethanamine

2-(4-fluorophenoxy)ethanamine (PubChem CID 3135849) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)ethanamine.

Molecular Properties

Compound Name2-(4-fluorophenoxy)ethanamine
PubChem CID3135849
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name2-(4-fluorophenoxy)ethanamine
SMILESNCCOc1ccc(F)cc1
InChIInChI=1S/C8H10FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,5-6,10H2
InChIKeyHTMIRIIZZGJJBK-UHFFFAOYSA-N
XLogP1.16
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)ethanamine?
The IUPAC name of 2-(4-fluorophenoxy)ethanamine (CID 3135849) is 2-(4-fluorophenoxy)ethanamine.
What is the SMILES notation for 2-(4-fluorophenoxy)ethanamine?
The canonical SMILES for 2-(4-fluorophenoxy)ethanamine is NCCOc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)ethanamine?
The InChIKey is HTMIRIIZZGJJBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,5-6,10H2.
What are the key properties of 2-(4-fluorophenoxy)ethanamine?
2-(4-fluorophenoxy)ethanamine has a molecular weight of 155.17 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)ethanamine is sourced from PubChem (CID 3135849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).