N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine

C15H24FNO — CID 55036773

IUPACN-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine
SMILESCCCCCOC(CNCC)c1ccccc1F
InChIInChI=1S/C15H24FNO/c1-3-5-8-11-18-15(12-17-4-2)13-9-6-7-10-14(13)16/h6-7,9-10,15,17H,3-5,8,11-12H2,1-2H3
InChIKeyPGDZNDCIXJCVCW-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.68
Rot. Bonds9

About N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine

N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine (PubChem CID 55036773) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine.

Molecular Properties

Compound NameN-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine
PubChem CID55036773
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC NameN-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine
SMILESCCCCCOC(CNCC)c1ccccc1F
InChIInChI=1S/C15H24FNO/c1-3-5-8-11-18-15(12-17-4-2)13-9-6-7-10-14(13)16/h6-7,9-10,15,17H,3-5,8,11-12H2,1-2H3
InChIKeyPGDZNDCIXJCVCW-UHFFFAOYSA-N
XLogP3.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-fluorophenyl)-2-pentoxyethyl]-2-methylpropan-2-amine
CID 62109223
2-(2-ethoxyethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 62105959
N-ethyl-2-heptoxy-2-(2-methoxyphenyl)ethanamine
CID 62109368
2-(2-cyclopropylethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 114157889
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
4-butoxy-N-ethyl-2-(2-fluorophenyl)butan-1-amine
CID 79439765
N-ethyl-2-(2-fluorophenyl)-2-(oxan-2-ylmethoxy)ethanamine
CID 62108277
N-[2-(2-fluorophenyl)-2-(3-methoxypropoxy)ethyl]-2-methylpropan-2-amine
CID 62108236
2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
CID 103405175
2-(3-chlorophenyl)-N-ethyl-2-octoxyethanamine
CID 63474835
N-[2-(2-fluorophenyl)-2-(2-propoxyethoxy)ethyl]-2-methylpropan-2-amine
CID 63685998
N-ethyl-2-(2-fluorophenyl)-3-methylpentan-1-amine
CID 79443669

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine?
The IUPAC name of N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine (CID 55036773) is N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine.
What is the SMILES notation for N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine?
The canonical SMILES for N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine is CCCCCOC(CNCC)c1ccccc1F.
What is the InChIKey of N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine?
The InChIKey is PGDZNDCIXJCVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-3-5-8-11-18-15(12-17-4-2)13-9-6-7-10-14(13)16/h6-7,9-10,15,17H,3-5,8,11-12H2,1-2H3.
What are the key properties of N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine?
N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine has a molecular weight of 253.36 g/mol, XLogP of 3.68, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-fluorophenyl)-2-pentoxyethanamine is sourced from PubChem (CID 55036773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).