N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine

C15H29F3N2O — CID 79912656

IUPACN-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine
SMILESCCNC1C(CN(CC)CC(F)(F)F)C(C)(C)OC1(C)C
InChIInChI=1S/C15H29F3N2O/c1-7-19-12-11(13(3,4)21-14(12,5)6)9-20(8-2)10-15(16,17)18/h11-12,19H,7-10H2,1-6H3
InChIKeyOZAHNPCGYSGATO-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.05
Rot. Bonds6

About N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine

N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine (PubChem CID 79912656) has the molecular formula C15H29F3N2O and a molecular weight of 310.40 g/mol. Its IUPAC name is N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine
PubChem CID79912656
Molecular FormulaC15H29F3N2O
Molecular Weight310.40 g/mol
Exact Mass310.22
IUPAC NameN-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine
SMILESCCNC1C(CN(CC)CC(F)(F)F)C(C)(C)OC1(C)C
InChIInChI=1S/C15H29F3N2O/c1-7-19-12-11(13(3,4)21-14(12,5)6)9-20(8-2)10-15(16,17)18/h11-12,19H,7-10H2,1-6H3
InChIKeyOZAHNPCGYSGATO-UHFFFAOYSA-N
XLogP3.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine with MolForge

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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
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
2,2,5,5-tetramethyl-N-(2,2,2-trifluoroethyl)oxolan-3-amine
CID 79915891
2,2,5,5-tetramethyl-N-(3,3,3-trifluoropropyl)oxolan-3-amine
CID 79927145
2,2,5,5-tetramethyl-N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine
CID 79928027
2,2,5,5-tetramethyl-N-[2-(trifluoromethyl)cyclohexyl]oxolan-3-amine
CID 79928143

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine?
The IUPAC name of N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine (CID 79912656) is N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine.
What is the SMILES notation for N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine?
The canonical SMILES for N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine is CCNC1C(CN(CC)CC(F)(F)F)C(C)(C)OC1(C)C.
What is the InChIKey of N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine?
The InChIKey is OZAHNPCGYSGATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29F3N2O/c1-7-19-12-11(13(3,4)21-14(12,5)6)9-20(8-2)10-15(16,17)18/h11-12,19H,7-10H2,1-6H3.
What are the key properties of N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine?
N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine has a molecular weight of 310.40 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2,5,5-tetramethyloxolan-3-amine is sourced from PubChem (CID 79912656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).