8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine

C10H17F3N2 — CID 43131529

IUPAC8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCC(F)(F)F)C2
InChIInChI=1S/C10H17F3N2/c1-15-8-2-3-9(15)5-7(4-8)14-6-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeyYYWMLUNMAMUFEN-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.76
Rot. Bonds2

About 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine

8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 43131529) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID43131529
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC Name8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCC(F)(F)F)C2
InChIInChI=1S/C10H17F3N2/c1-15-8-2-3-9(15)5-7(4-8)14-6-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeyYYWMLUNMAMUFEN-UHFFFAOYSA-N
XLogP1.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine with MolForge

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Related Compounds

8-Methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 408394
endo-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 736442
2-(2-Pyrrolidin-1-ylethyl)piperidine
CID 231871
8-(2,2,2-Trifluoroethyl)-8-azabicyclo(3.2.1)octan-3-amine dihydrochloride
CID 18919606
3,3-Difluoro-8-azabicyclo(3.2.1)octane hydrochloride
CID 57416927
8-(Propan-2-yl)-8-azabicyclo[3.2.1]octan-3-amine dihydrochloride
CID 67212524
(1R,3R,5S)-8-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine dihydrochloride
CID 70194578
3,3-Difluoro-4-(pyrrolidin-1-yl)piperidine hydrochloride
CID 164186593
N-cyclohexyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 2836880
N-cycloheptyl-1-ethyl-4-piperidinamine
CID 784532
N-(2,2-difluoroethyl)-1-methylpiperidin-4-amine
CID 50896642
N,8-dimethyl-8-azabicyclo[3.2.1]octan-6-amine
CID 165979720

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 43131529) is 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine is CN1C2CCC1CC(NCC(F)(F)F)C2.
What is the InChIKey of 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is YYWMLUNMAMUFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c1-15-8-2-3-9(15)5-7(4-8)14-6-10(11,12)13/h7-9,14H,2-6H2,1H3.
What are the key properties of 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine?
8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 222.25 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 43131529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).