2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine

C10H15F6NO2 — CID 102721967

IUPAC2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine
SMILESCNC(COC(C(F)(F)F)C(F)(F)F)C1CCOC1
InChIInChI=1S/C10H15F6NO2/c1-17-7(6-2-3-18-4-6)5-19-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3
InChIKeySBWMZBMIUHBMIG-UHFFFAOYSA-N
MW295.22 g/mol
LogP2.12
Rot. Bonds5

About 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine

2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine (PubChem CID 102721967) has the molecular formula C10H15F6NO2 and a molecular weight of 295.22 g/mol. Its IUPAC name is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine
PubChem CID102721967
Molecular FormulaC10H15F6NO2
Molecular Weight295.22 g/mol
Exact Mass295.10
IUPAC Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine
SMILESCNC(COC(C(F)(F)F)C(F)(F)F)C1CCOC1
InChIInChI=1S/C10H15F6NO2/c1-17-7(6-2-3-18-4-6)5-19-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3
InChIKeySBWMZBMIUHBMIG-UHFFFAOYSA-N
XLogP2.12
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.22
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine (CID 102721967) is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine is CNC(COC(C(F)(F)F)C(F)(F)F)C1CCOC1.
What is the InChIKey of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine?
The InChIKey is SBWMZBMIUHBMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F6NO2/c1-17-7(6-2-3-18-4-6)5-19-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3.
What are the key properties of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine?
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine has a molecular weight of 295.22 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 102721967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).