1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol

C10H13F2NO2 — CID 60969966

IUPAC1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol
SMILESCCONCC(O)c1cc(F)ccc1F
InChIInChI=1S/C10H13F2NO2/c1-2-15-13-6-10(14)8-5-7(11)3-4-9(8)12/h3-5,10,13-14H,2,6H2,1H3
InChIKeyLIZDQFYKLGESPF-UHFFFAOYSA-N
MW217.22 g/mol
LogP1.54
Rot. Bonds5

About 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol

1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol (PubChem CID 60969966) has the molecular formula C10H13F2NO2 and a molecular weight of 217.22 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol
PubChem CID60969966
Molecular FormulaC10H13F2NO2
Molecular Weight217.22 g/mol
Exact Mass217.09
IUPAC Name1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol
SMILESCCONCC(O)c1cc(F)ccc1F
InChIInChI=1S/C10H13F2NO2/c1-2-15-13-6-10(14)8-5-7(11)3-4-9(8)12/h3-5,10,13-14H,2,6H2,1H3
InChIKeyLIZDQFYKLGESPF-UHFFFAOYSA-N
XLogP1.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2,5-difluorophenyl)-2-(methylamino)ethanol
CID 60904118
1-(2,5-difluorophenyl)-2-(3-propoxypropylamino)ethanol
CID 82944241
1-[[2-(2,5-difluorophenyl)-2-hydroxyethyl]amino]-3-ethylpentan-2-ol
CID 106285464
1-(2,5-difluorophenyl)-N-ethoxyethanamine
CID 115282507
1-(2,5-difluorophenyl)-2-(4-methylpentylamino)ethanol
CID 54893307
1-(2,5-difluorophenyl)-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]ethanol
CID 81347558
1-(2,5-difluorophenyl)-2-[1-(4-fluorophenyl)ethylamino]ethanol
CID 60980572
2-anilino-1-(2,5-difluorophenyl)ethanol
CID 55026297
1-(2,5-difluorophenyl)-2-(3,4,5-trifluoroanilino)ethanol
CID 62811175
1-(2,5-difluorophenyl)-2-(2,4,5-trifluoroanilino)ethanol
CID 62815556
2-(but-3-yn-2-ylamino)-1-(2,5-difluorophenyl)ethanol
CID 114416982
2-(2,6-difluoro-3-methylanilino)-1-(2,5-difluorophenyl)ethanol
CID 82801499

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol?
The IUPAC name of 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol (CID 60969966) is 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol is CCONCC(O)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol?
The InChIKey is LIZDQFYKLGESPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2NO2/c1-2-15-13-6-10(14)8-5-7(11)3-4-9(8)12/h3-5,10,13-14H,2,6H2,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol?
1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol has a molecular weight of 217.22 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-(ethoxyamino)ethanol is sourced from PubChem (CID 60969966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).