2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol

C6H13F3N2O — CID 104859142

IUPAC2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESNCCN(CCO)CC(F)(F)F
InChIInChI=1S/C6H13F3N2O/c7-6(8,9)5-11(2-1-10)3-4-12/h12H,1-5,10H2
InChIKeyNYPJQJUEXHATDB-UHFFFAOYSA-N
MW186.18 g/mol
LogP-0.20
Rot. Bonds5

About 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol

2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 104859142) has the molecular formula C6H13F3N2O and a molecular weight of 186.18 g/mol. Its IUPAC name is 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID104859142
Molecular FormulaC6H13F3N2O
Molecular Weight186.18 g/mol
Exact Mass186.10
IUPAC Name2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESNCCN(CCO)CC(F)(F)F
InChIInChI=1S/C6H13F3N2O/c7-6(8,9)5-11(2-1-10)3-4-12/h12H,1-5,10H2
InChIKeyNYPJQJUEXHATDB-UHFFFAOYSA-N
XLogP-0.20
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.18
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-Bis(2-aminoethyl)ethanolamine
CID 16070
2-((2-Aminoethyl)(methyl)amino)ethan-1-ol
CID 10887881
2-[(2,2,2-Trifluoroethyl)amino]ethan-1-ol
CID 14513794
2-[(2,2-Difluoroethyl)amino]ethan-1-ol
CID 60922928
3-((2-Aminoethyl)amino)-1,1,1-trifluoropropan-2-ol
CID 63899233
3-[2-Aminoethyl(methyl)amino]-1,1,1-trifluoropropan-2-ol
CID 63900067
3-{[2-(Dimethylamino)ethyl]amino}-1,1,1-trifluoropropan-2-ol
CID 63902289
1,1,1-Trifluoro-3-{methyl[2-(methylamino)ethyl]amino}propan-2-ol
CID 64083661
N'-methyl-N'-[2-(trifluoromethoxy)ethyl]ethane-1,2-diamine
CID 65804251
2-[(2-Amino-1-fluoroethyl)amino]ethanol
CID 87643715
2-[2-Aminoethyl(fluoro)amino]ethanol
CID 87643716
2-(1,1,2-Trifluoroethylamino)ethanol
CID 88626793

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol (CID 104859142) is 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol is NCCN(CCO)CC(F)(F)F.
What is the InChIKey of 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is NYPJQJUEXHATDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F3N2O/c7-6(8,9)5-11(2-1-10)3-4-12/h12H,1-5,10H2.
What are the key properties of 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol?
2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 186.18 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 104859142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).