2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine

C6H6F9N — CID 14364151

IUPAC2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine
SMILESFC(F)(F)CN(CC(F)(F)F)CC(F)(F)F
InChIInChI=1S/C6H6F9N/c7-4(8,9)1-16(2-5(10,11)12)3-6(13,14)15/h1-3H2
InChIKeyMKWSAJIEQHPRGY-UHFFFAOYSA-N
MW263.10 g/mol
LogP2.98
Rot. Bonds3

About 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine

2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine (PubChem CID 14364151) has the molecular formula C6H6F9N and a molecular weight of 263.10 g/mol. Its IUPAC name is 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine
PubChem CID14364151
Molecular FormulaC6H6F9N
Molecular Weight263.10 g/mol
Exact Mass263.04
IUPAC Name2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine
SMILESFC(F)(F)CN(CC(F)(F)F)CC(F)(F)F
InChIInChI=1S/C6H6F9N/c7-4(8,9)1-16(2-5(10,11)12)3-6(13,14)15/h1-3H2
InChIKeyMKWSAJIEQHPRGY-UHFFFAOYSA-N
XLogP2.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.10
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine?
The IUPAC name of 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine (CID 14364151) is 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine is FC(F)(F)CN(CC(F)(F)F)CC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine?
The InChIKey is MKWSAJIEQHPRGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F9N/c7-4(8,9)1-16(2-5(10,11)12)3-6(13,14)15/h1-3H2.
What are the key properties of 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine?
2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine has a molecular weight of 263.10 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N,N-bis(2,2,2-trifluoroethyl)ethanamine is sourced from PubChem (CID 14364151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).