2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine

C13H25F3N2O — CID 79930178

IUPAC2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine
SMILESCN(CCC(F)(F)F)CC1C(N)C(C)(C)OC1(C)C
InChIInChI=1S/C13H25F3N2O/c1-11(2)9(10(17)12(3,4)19-11)8-18(5)7-6-13(14,15)16/h9-10H,6-8,17H2,1-5H3
InChIKeyHRICSKSIMZRZCP-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.40
Rot. Bonds4

About 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine

2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine (PubChem CID 79930178) has the molecular formula C13H25F3N2O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine
PubChem CID79930178
Molecular FormulaC13H25F3N2O
Molecular Weight282.35 g/mol
Exact Mass282.19
IUPAC Name2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine
SMILESCN(CCC(F)(F)F)CC1C(N)C(C)(C)OC1(C)C
InChIInChI=1S/C13H25F3N2O/c1-11(2)9(10(17)12(3,4)19-11)8-18(5)7-6-13(14,15)16/h9-10H,6-8,17H2,1-5H3
InChIKeyHRICSKSIMZRZCP-UHFFFAOYSA-N
XLogP2.40
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,5,5-tetramethyl-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]oxolan-3-amine
CID 79911555
N,2,2,5,5-pentamethyl-4-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
CID 79912655
N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 79912656
4-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2,5,5-pentamethyloxolan-3-amine
CID 79912657
N,2,2,5,5-pentamethyl-4-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
CID 79912771
2,2,5,5-tetramethyl-4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propyloxolan-3-amine
CID 79913101
N-ethyl-2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine
CID 79914542
2,2,5,5-Tetramethyl-4-[[3-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-amine
CID 79914543
2,2,5,5-Tetramethyl-4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-amine
CID 79914713
3-(aminomethyl)-2,2,5,5-tetramethyl-N-(2,2,2-trifluoroethyl)oxolan-3-amine
CID 79928197
N,2,2,5,5-pentamethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine
CID 79930091
2,2,5,5-Tetramethyl-4-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
CID 79933451

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine (CID 79930178) is 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine is CN(CCC(F)(F)F)CC1C(N)C(C)(C)OC1(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine?
The InChIKey is HRICSKSIMZRZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25F3N2O/c1-11(2)9(10(17)12(3,4)19-11)8-18(5)7-6-13(14,15)16/h9-10H,6-8,17H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine?
2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine has a molecular weight of 282.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-4-[[methyl(3,3,3-trifluoropropyl)amino]methyl]oxolan-3-amine is sourced from PubChem (CID 79930178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).