2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol

C9H12F3N3O — CID 107478357

IUPAC2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol
SMILESNc1ccc(N(CCO)CC(F)(F)F)nc1
InChIInChI=1S/C9H12F3N3O/c10-9(11,12)6-15(3-4-16)8-2-1-7(13)5-14-8/h1-2,5,16H,3-4,6,13H2
InChIKeyFJUUWSOMEONUTC-UHFFFAOYSA-N
MW235.21 g/mol
LogP1.02
Rot. Bonds4

About 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol

2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 107478357) has the molecular formula C9H12F3N3O and a molecular weight of 235.21 g/mol. Its IUPAC name is 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID107478357
Molecular FormulaC9H12F3N3O
Molecular Weight235.21 g/mol
Exact Mass235.09
IUPAC Name2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol
SMILESNc1ccc(N(CCO)CC(F)(F)F)nc1
InChIInChI=1S/C9H12F3N3O/c10-9(11,12)6-15(3-4-16)8-2-1-7(13)5-14-8/h1-2,5,16H,3-4,6,13H2
InChIKeyFJUUWSOMEONUTC-UHFFFAOYSA-N
XLogP1.02
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.21
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol with MolForge

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Related Compounds

2-[4-amino-N-(2,2,2-trifluoroethyl)anilino]ethanol
CID 107478278
2-[[5-(ethylaminomethyl)-2-pyridinyl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107481493
2-[2,2,2-trifluoroethyl-[6-(trifluoromethyl)pyridazin-3-yl]amino]ethanol
CID 107484538
2-[[5-[(2-methylpropylamino)methyl]-2-pyridinyl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107481548
2-[[4-(hydroxymethyl)-2-pyridinyl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107484659
2-[(6-amino-2-methylpyrimidin-4-yl)-(2,2,2-trifluoroethyl)amino]ethanol
CID 107495365
2-[(2-amino-6-hydrazinylpyrimidin-4-yl)-(2,2,2-trifluoroethyl)amino]ethanol
CID 107495464
6-[2-aminoethyl(2,2,2-trifluoroethyl)amino]pyridine-3-sulfonamide
CID 107494274
2-[[3-(aminomethyl)quinolin-4-yl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107478493
6-[propyl(2,2,2-trifluoroethyl)amino]pyridine-3-carbaldehyde
CID 80638350
6-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]pyridin-3-amine
CID 107340164
2-[[2-amino-6-(ethylamino)pyrimidin-4-yl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107495264

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol (CID 107478357) is 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol is Nc1ccc(N(CCO)CC(F)(F)F)nc1.
What is the InChIKey of 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is FJUUWSOMEONUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F3N3O/c10-9(11,12)6-15(3-4-16)8-2-1-7(13)5-14-8/h1-2,5,16H,3-4,6,13H2.
What are the key properties of 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol?
2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 235.21 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-2-pyridinyl)-(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 107478357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).