2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine

C15H24FNO3 — CID 103405175

IUPAC2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
SMILESCNCC(OCCCOCCOC)c1ccccc1F
InChIInChI=1S/C15H24FNO3/c1-17-12-15(13-6-3-4-7-14(13)16)20-9-5-8-19-11-10-18-2/h3-4,6-7,15,17H,5,8-12H2,1-2H3
InChIKeyGVOSMLNDGCOFEN-UHFFFAOYSA-N
MW285.36 g/mol
LogP2.16
Rot. Bonds11

About 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine

2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine (PubChem CID 103405175) has the molecular formula C15H24FNO3 and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
PubChem CID103405175
Molecular FormulaC15H24FNO3
Molecular Weight285.36 g/mol
Exact Mass285.17
IUPAC Name2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
SMILESCNCC(OCCCOCCOC)c1ccccc1F
InChIInChI=1S/C15H24FNO3/c1-17-12-15(13-6-3-4-7-14(13)16)20-9-5-8-19-11-10-18-2/h3-4,6-7,15,17H,5,8-12H2,1-2H3
InChIKeyGVOSMLNDGCOFEN-UHFFFAOYSA-N
XLogP2.16
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]ethanamine
CID 103401296
2-[3-(2-methoxyethoxy)propoxy]-N-methyl-2-phenylethanamine
CID 103405244
2-(2-chlorophenyl)-2-[2-(3-methoxypropoxy)ethoxy]-N-methylethanamine
CID 103180434
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
N-[2-(2-fluorophenyl)-2-(3-methoxypropoxy)ethyl]-2-methylpropan-2-amine
CID 62108236
(2R)-2-(2-fluorophenyl)-2-methoxy-N-methylethanamine
CID 94355994
2-(2-fluorophenyl)-2-(3-methoxy-3-methylbutoxy)-N-methylethanamine
CID 106667015
N-ethyl-2-(2-fluorophenyl)-5-(2-methoxyethoxy)pentan-1-amine
CID 103412646
2-(3-bromophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
CID 103405191
2-(4-fluorophenyl)-2-(3-methoxypropoxy)-N-methylethanamine
CID 62107169
2-(2-fluorophenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 62107488
2-(2-fluorophenyl)-4-(2-methoxyethoxy)-N-(2-methoxyethyl)butan-1-amine
CID 79436793

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine?
The IUPAC name of 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine (CID 103405175) is 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine is CNCC(OCCCOCCOC)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine?
The InChIKey is GVOSMLNDGCOFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO3/c1-17-12-15(13-6-3-4-7-14(13)16)20-9-5-8-19-11-10-18-2/h3-4,6-7,15,17H,5,8-12H2,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine?
2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine has a molecular weight of 285.36 g/mol, XLogP of 2.16, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine is sourced from PubChem (CID 103405175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).