2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine

C14H16FNOS — CID 63935769

IUPAC2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine
SMILESFc1ccccc1COCCNCc1cccs1
InChIInChI=1S/C14H16FNOS/c15-14-6-2-1-4-12(14)11-17-8-7-16-10-13-5-3-9-18-13/h1-6,9,16H,7-8,10-11H2
InChIKeyBQTIEYRGNQDQFN-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.19
Rot. Bonds7

About 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine

2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine (PubChem CID 63935769) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine
PubChem CID63935769
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine
SMILESFc1ccccc1COCCNCc1cccs1
InChIInChI=1S/C14H16FNOS/c15-14-6-2-1-4-12(14)11-17-8-7-16-10-13-5-3-9-18-13/h1-6,9,16H,7-8,10-11H2
InChIKeyBQTIEYRGNQDQFN-UHFFFAOYSA-N
XLogP3.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.19
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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Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine (CID 63935769) is 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine is Fc1ccccc1COCCNCc1cccs1.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine?
The InChIKey is BQTIEYRGNQDQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c15-14-6-2-1-4-12(14)11-17-8-7-16-10-13-5-3-9-18-13/h1-6,9,16H,7-8,10-11H2.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine?
2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine has a molecular weight of 265.35 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-N-(thiophen-2-ylmethyl)ethanamine is sourced from PubChem (CID 63935769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).