1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol

C10H15FN2O2 — CID 104739344

IUPAC1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol
SMILESCOCCNCC(O)c1ccncc1F
InChIInChI=1S/C10H15FN2O2/c1-15-5-4-13-7-10(14)8-2-3-12-6-9(8)11/h2-3,6,10,13-14H,4-5,7H2,1H3
InChIKeyVYPRXOILCNHZAB-UHFFFAOYSA-N
MW214.24 g/mol
LogP0.49
Rot. Bonds6

About 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol

1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol (PubChem CID 104739344) has the molecular formula C10H15FN2O2 and a molecular weight of 214.24 g/mol. Its IUPAC name is 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol
PubChem CID104739344
Molecular FormulaC10H15FN2O2
Molecular Weight214.24 g/mol
Exact Mass214.11
IUPAC Name1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol
SMILESCOCCNCC(O)c1ccncc1F
InChIInChI=1S/C10H15FN2O2/c1-15-5-4-13-7-10(14)8-2-3-12-6-9(8)11/h2-3,6,10,13-14H,4-5,7H2,1H3
InChIKeyVYPRXOILCNHZAB-UHFFFAOYSA-N
XLogP0.49
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(3-fluoro-4-pyridinyl)-3-methoxypropan-1-ol
CID 104737985
3-(3-fluoro-4-pyridinyl)-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 104739049
1-(3-fluoro-4-pyridinyl)-3-methoxy-3-methylbutan-1-ol
CID 103027695
1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine
CID 104738162
1-(2-chloro-6-fluorophenyl)-2-(2-methoxyethylamino)ethanol
CID 62774538
[1-(3-fluoro-4-pyridinyl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102930056
1-(2,4-dimethylphenyl)-2-(2-methoxyethylamino)ethanol
CID 62772788
1-(3-fluoro-4-pyridinyl)-4-methoxy-N-propylbutan-1-amine
CID 113447246
1-(3-fluoro-4-pyridinyl)-2-methylsulfonylethanol
CID 115834015
1-(2,4-difluorophenyl)-2-[2-[2-methoxyethyl(methyl)amino]ethylamino]ethanol
CID 62842752
4-[[2-(2,4-difluorophenyl)-2-hydroxyethyl]amino]-1-methoxybutan-2-ol
CID 106246645
1-(2,4-difluorophenyl)-2-(2-ethoxyethylamino)ethanol
CID 54937805

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol?
The IUPAC name of 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol (CID 104739344) is 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol.
What is the SMILES notation for 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol?
The canonical SMILES for 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol is COCCNCC(O)c1ccncc1F.
What is the InChIKey of 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol?
The InChIKey is VYPRXOILCNHZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O2/c1-15-5-4-13-7-10(14)8-2-3-12-6-9(8)11/h2-3,6,10,13-14H,4-5,7H2,1H3.
What are the key properties of 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol?
1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol has a molecular weight of 214.24 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol is sourced from PubChem (CID 104739344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).