2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine

C13H25F3N2O — CID 102746094

IUPAC2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(CNCC(F)(F)F)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H25F3N2O/c1-10(6-17-7-13(14,15)16)18-8-11(2,3)19-12(4,5)9-18/h10,17H,6-9H2,1-5H3
InChIKeyRBWYNZGWOOZSHU-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.42
Rot. Bonds4

About 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine

2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine (PubChem CID 102746094) has the molecular formula C13H25F3N2O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine.

Molecular Properties

Compound Name2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
PubChem CID102746094
Molecular FormulaC13H25F3N2O
Molecular Weight282.35 g/mol
Exact Mass282.19
IUPAC Name2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(CNCC(F)(F)F)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H25F3N2O/c1-10(6-17-7-13(14,15)16)18-8-11(2,3)19-12(4,5)9-18/h10,17H,6-9H2,1-5H3
InChIKeyRBWYNZGWOOZSHU-UHFFFAOYSA-N
XLogP2.42
TPSA24.50 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 ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-amine
CID 102745971
N-(2,2,2-trifluoroethyl)-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propan-1-amine
CID 62557146
N-[2-(2,2,6,6-tetramethylmorpholin-4-yl)propyl]cyclopentanamine
CID 102746148
2-(1-oxo-1,4-thiazinan-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62569980
2-(3-methylpyrrolidin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62570690
2-(4-propylpiperidin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55087361
2-(4-ethoxypiperidin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55087654
2-(4-ethyl-3-methylpiperazin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 63619316
N,3-dimethyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-amine
CID 102746082
3-(2,2,6,6-tetramethylmorpholin-4-yl)butanoic acid
CID 102744531
ethane;2,2,6,6-tetramethyl-4-propan-2-ylmorpholine
CID 178173229
2-(2,2-dimethylmorpholin-4-yl)-N-ethylpropan-1-amine
CID 62433108

Frequently Asked Questions

What is the IUPAC name of 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The IUPAC name of 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine (CID 102746094) is 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine.
What is the SMILES notation for 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The canonical SMILES for 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine is CC(CNCC(F)(F)F)N1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The InChIKey is RBWYNZGWOOZSHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25F3N2O/c1-10(6-17-7-13(14,15)16)18-8-11(2,3)19-12(4,5)9-18/h10,17H,6-9H2,1-5H3.
What are the key properties of 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine?
2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine has a molecular weight of 282.35 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,6,6-tetramethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine is sourced from PubChem (CID 102746094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).