2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine

C10H18F3NO — CID 105052775

IUPAC2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
SMILESCC1(C)CC(C(N)C(F)(F)F)C(C)(C)O1
InChIInChI=1S/C10H18F3NO/c1-8(2)5-6(9(3,4)15-8)7(14)10(11,12)13/h6-7H,5,14H2,1-4H3
InChIKeyMDMYGFKUSCEFCM-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.47
Rot. Bonds1

About 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine

2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine (PubChem CID 105052775) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
PubChem CID105052775
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
SMILESCC1(C)CC(C(N)C(F)(F)F)C(C)(C)O1
InChIInChI=1S/C10H18F3NO/c1-8(2)5-6(9(3,4)15-8)7(14)10(11,12)13/h6-7H,5,14H2,1-4H3
InChIKeyMDMYGFKUSCEFCM-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine (CID 105052775) is 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine is CC1(C)CC(C(N)C(F)(F)F)C(C)(C)O1.
What is the InChIKey of 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The InChIKey is MDMYGFKUSCEFCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-8(2)5-6(9(3,4)15-8)7(14)10(11,12)13/h6-7H,5,14H2,1-4H3.
What are the key properties of 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine has a molecular weight of 225.25 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine is sourced from PubChem (CID 105052775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).