2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol

C7H8F2N2O — CID 55294647

IUPAC2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol
SMILESNC(CO)c1ccc(F)nc1F
InChIInChI=1S/C7H8F2N2O/c8-6-2-1-4(5(10)3-12)7(9)11-6/h1-2,5,12H,3,10H2
InChIKeyONVGLIXXKIXQPV-UHFFFAOYSA-N
MW174.15 g/mol
LogP0.35
Rot. Bonds2

About 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol

2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol (PubChem CID 55294647) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol
PubChem CID55294647
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol
SMILESNC(CO)c1ccc(F)nc1F
InChIInChI=1S/C7H8F2N2O/c8-6-2-1-4(5(10)3-12)7(9)11-6/h1-2,5,12H,3,10H2
InChIKeyONVGLIXXKIXQPV-UHFFFAOYSA-N
XLogP0.35
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-(2,6-difluoro-3-pyridinyl)propan-1-amine
CID 55292186
1-(2,6-difluoro-3-pyridinyl)propane-1,2,3-triol
CID 170817617
3-amino-3-(2,6-difluoro-3-pyridinyl)propanenitrile
CID 55294847
(1S)-1-(2,6-difluoro-3-pyridinyl)prop-2-en-1-amine
CID 55292187
1-(2,6-difluoro-3-pyridinyl)butane-1,2,4-triol
CID 171872056
(2R)-2-amino-2-(2,3,4-trifluorophenyl)ethanol;hydrochloride
CID 171225380
(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol
CID 96740448
4-(1-amino-2-hydroxyethyl)-3-fluorophenol
CID 55282976
(2R)-2-amino-2-(2,4-difluorophenyl)ethanol;hydrochloride
CID 67034313
4-(2,6-difluoro-3-pyridinyl)-3,4-dihydroxybutanamide
CID 171898930
2-amino-2-(4-bromo-2-fluorophenyl)ethanol
CID 61056024
(2R)-2-amino-2-[2-(difluoromethyl)-5-fluorophenyl]ethanol
CID 66514186

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol?
The IUPAC name of 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol (CID 55294647) is 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol.
What is the SMILES notation for 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol?
The canonical SMILES for 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol is NC(CO)c1ccc(F)nc1F.
What is the InChIKey of 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol?
The InChIKey is ONVGLIXXKIXQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c8-6-2-1-4(5(10)3-12)7(9)11-6/h1-2,5,12H,3,10H2.
What are the key properties of 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol?
2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol has a molecular weight of 174.15 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,6-difluoro-3-pyridinyl)ethanol is sourced from PubChem (CID 55294647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).