2-[2-(4-fluorophenoxy)ethoxy]ethanamine

C10H14FNO2 — CID 28749658

IUPAC2-[2-(4-fluorophenoxy)ethoxy]ethanamine
SMILESNCCOCCOc1ccc(F)cc1
InChIInChI=1S/C10H14FNO2/c11-9-1-3-10(4-2-9)14-8-7-13-6-5-12/h1-4H,5-8,12H2
InChIKeyMWRCVSHLMZGDAW-UHFFFAOYSA-N
MW199.23 g/mol
LogP1.18
Rot. Bonds6

About 2-[2-(4-fluorophenoxy)ethoxy]ethanamine

2-[2-(4-fluorophenoxy)ethoxy]ethanamine (PubChem CID 28749658) has the molecular formula C10H14FNO2 and a molecular weight of 199.23 g/mol. Its IUPAC name is 2-[2-(4-fluorophenoxy)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(4-fluorophenoxy)ethoxy]ethanamine
PubChem CID28749658
Molecular FormulaC10H14FNO2
Molecular Weight199.23 g/mol
Exact Mass199.10
IUPAC Name2-[2-(4-fluorophenoxy)ethoxy]ethanamine
SMILESNCCOCCOc1ccc(F)cc1
InChIInChI=1S/C10H14FNO2/c11-9-1-3-10(4-2-9)14-8-7-13-6-5-12/h1-4H,5-8,12H2
InChIKeyMWRCVSHLMZGDAW-UHFFFAOYSA-N
XLogP1.18
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethanamine
CID 71104188
N-[4-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]phenyl]hydroxylamine
CID 177015138
O-[2-(4-fluorophenoxy)ethyl]hydroxylamine;hydrochloride
CID 45158554
4-[2-(2-aminoethoxy)ethoxy]benzamide
CID 82146872
2-[2-[2-[2-[2-[2-[2-[2-[2-(4-nitrophenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 170563879
2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
[4-[2-[2-[2-[4-(aminomethyl)phenoxy]ethoxy]ethoxy]ethoxy]phenyl]methanamine
CID 46222769
1-fluoro-4-[2-(4-iodophenoxy)ethoxy]benzene
CID 141496951
2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethoxy]ethanamine
CID 28749749
2-[2-[2-(4-fluorophenoxy)ethoxy]ethylamino]ethanol
CID 2280472
N-[2-[2-(4-fluorophenoxy)ethoxy]ethyl]-2-methylpropan-2-amine
CID 40539155
2-[2-[bis(4-fluorophenyl)methoxy]ethoxy]ethanamine
CID 21187771

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenoxy)ethoxy]ethanamine?
The IUPAC name of 2-[2-(4-fluorophenoxy)ethoxy]ethanamine (CID 28749658) is 2-[2-(4-fluorophenoxy)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(4-fluorophenoxy)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(4-fluorophenoxy)ethoxy]ethanamine is NCCOCCOc1ccc(F)cc1.
What is the InChIKey of 2-[2-(4-fluorophenoxy)ethoxy]ethanamine?
The InChIKey is MWRCVSHLMZGDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2/c11-9-1-3-10(4-2-9)14-8-7-13-6-5-12/h1-4H,5-8,12H2.
What are the key properties of 2-[2-(4-fluorophenoxy)ethoxy]ethanamine?
2-[2-(4-fluorophenoxy)ethoxy]ethanamine has a molecular weight of 199.23 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenoxy)ethoxy]ethanamine is sourced from PubChem (CID 28749658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).