2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine

C14H22FNO2 — CID 62105959

IUPAC2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
SMILESCCNCC(OCCOCC)c1ccccc1F
InChIInChI=1S/C14H22FNO2/c1-3-16-11-14(18-10-9-17-4-2)12-7-5-6-8-13(12)15/h5-8,14,16H,3-4,9-11H2,1-2H3
InChIKeyOEMJJOCSVUAHAH-UHFFFAOYSA-N
MW255.33 g/mol
LogP2.53
Rot. Bonds9

About 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine

2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine (PubChem CID 62105959) has the molecular formula C14H22FNO2 and a molecular weight of 255.33 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
PubChem CID62105959
Molecular FormulaC14H22FNO2
Molecular Weight255.33 g/mol
Exact Mass255.16
IUPAC Name2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
SMILESCCNCC(OCCOCC)c1ccccc1F
InChIInChI=1S/C14H22FNO2/c1-3-16-11-14(18-10-9-17-4-2)12-7-5-6-8-13(12)15/h5-8,14,16H,3-4,9-11H2,1-2H3
InChIKeyOEMJJOCSVUAHAH-UHFFFAOYSA-N
XLogP2.53
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.33
LogP ≤ 52.53
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

N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine
CID 55036773
2-(2-cyclopropylethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 114157889
N-[2-(2-fluorophenyl)-2-(2-propoxyethoxy)ethyl]-2-methylpropan-2-amine
CID 63685998
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
N-ethyl-2-(2-fluorophenyl)-3-methylpentan-1-amine
CID 79443669
1-[2-bromo-1-(2-propoxyethoxy)ethyl]-2-fluorobenzene
CID 63684700
2-(2-bromophenyl)-N-ethyl-2-(2-propan-2-yloxyethoxy)ethanamine
CID 62108481
N-ethyl-2-(2-fluorophenyl)-2-(oxan-2-ylmethoxy)ethanamine
CID 62108277
2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
CID 103405175
N-[2-(2-ethoxyethoxy)-2-phenylethyl]-2-methylpropan-1-amine
CID 55072970
N-ethyl-2-(2-fluorophenyl)-5-(2-methoxyethoxy)pentan-1-amine
CID 103412646
N-[2-(2-bromophenyl)-2-(2-ethoxyethoxy)ethyl]-2-methylpropan-2-amine
CID 62108632

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine (CID 62105959) is 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine is CCNCC(OCCOCC)c1ccccc1F.
What is the InChIKey of 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The InChIKey is OEMJJOCSVUAHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FNO2/c1-3-16-11-14(18-10-9-17-4-2)12-7-5-6-8-13(12)15/h5-8,14,16H,3-4,9-11H2,1-2H3.
What are the key properties of 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine?
2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine has a molecular weight of 255.33 g/mol, XLogP of 2.53, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 62105959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).