2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine

C11H21F3N2O — CID 83013777

IUPAC2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine
SMILESCC1CCCC(C)N1NCCOCC(F)(F)F
InChIInChI=1S/C11H21F3N2O/c1-9-4-3-5-10(2)16(9)15-6-7-17-8-11(12,13)14/h9-10,15H,3-8H2,1-2H3
InChIKeyFWHJPFVZXTVWHP-UHFFFAOYSA-N
MW254.30 g/mol
LogP2.33
Rot. Bonds5

About 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine

2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine (PubChem CID 83013777) has the molecular formula C11H21F3N2O and a molecular weight of 254.30 g/mol. Its IUPAC name is 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine
PubChem CID83013777
Molecular FormulaC11H21F3N2O
Molecular Weight254.30 g/mol
Exact Mass254.16
IUPAC Name2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine
SMILESCC1CCCC(C)N1NCCOCC(F)(F)F
InChIInChI=1S/C11H21F3N2O/c1-9-4-3-5-10(2)16(9)15-6-7-17-8-11(12,13)14/h9-10,15H,3-8H2,1-2H3
InChIKeyFWHJPFVZXTVWHP-UHFFFAOYSA-N
XLogP2.33
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethyl-N-[3-(2,2,2-trifluoroethoxy)propyl]piperidin-1-amine
CID 83013565
N-[2-(trifluoromethoxy)ethyl]piperidin-1-amine
CID 83014285
N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine
CID 83014482
N-[3-(2,2,2-trifluoroethoxy)propyl]piperidin-1-amine
CID 83014690
2,6-dimethyl-N-[2-(trifluoromethoxy)ethyl]piperidin-1-amine
CID 83021013
3-[(2,6-Dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol
CID 83021339
[4,4,4-Trifluoro-1-(4-methylmorpholin-2-yl)butyl]hydrazine
CID 105244265
[5,5,5-Trifluoro-1-(4-methylmorpholin-2-yl)pentyl]hydrazine
CID 105244370
[1-(4-Ethylmorpholin-2-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105247461
[1-(4-Ethylmorpholin-2-yl)-5,5,5-trifluoropentyl]hydrazine
CID 105247559
[4,4,4-Trifluoro-1-(4-propylmorpholin-2-yl)butyl]hydrazine
CID 105247762
[4,4,4-Trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine
CID 105248002

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine (CID 83013777) is 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine is CC1CCCC(C)N1NCCOCC(F)(F)F.
What is the InChIKey of 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine?
The InChIKey is FWHJPFVZXTVWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O/c1-9-4-3-5-10(2)16(9)15-6-7-17-8-11(12,13)14/h9-10,15H,3-8H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine?
2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine has a molecular weight of 254.30 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-1-amine is sourced from PubChem (CID 83013777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).