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

C10H19FN2 — CID 130504670

IUPAC8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCNC1CC2CCC(C1)N2CCF
InChIInChI=1S/C10H19FN2/c1-12-8-6-9-2-3-10(7-8)13(9)5-4-11/h8-10,12H,2-7H2,1H3
InChIKeyVJPFFWCOQNRONW-UHFFFAOYSA-N
MW186.27 g/mol
LogP1.17
Rot. Bonds3

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

8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 130504670) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID130504670
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCNC1CC2CCC(C1)N2CCF
InChIInChI=1S/C10H19FN2/c1-12-8-6-9-2-3-10(7-8)13(9)5-4-11/h8-10,12H,2-7H2,1H3
InChIKeyVJPFFWCOQNRONW-UHFFFAOYSA-N
XLogP1.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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
8-Cyclopropyl-8-azabicyclo[3.2.1]octan-3-amine
CID 45792677
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
N-cyclohexyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 2836880
N-cycloheptyl-1-ethyl-4-piperidinamine
CID 784532
N,8-dimethyl-8-azabicyclo[3.2.1]octan-6-amine
CID 165979720
N-[2-(1-methyl-2-pyrrolidinyl)ethyl]cycloheptanamine
CID 2845256
8-Azabicyclo[3.2.1]octan-3-amine
CID 13565856

Frequently Asked Questions

What is the IUPAC name of 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (CID 130504670) is 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine is CNC1CC2CCC(C1)N2CCF.
What is the InChIKey of 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is VJPFFWCOQNRONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-12-8-6-9-2-3-10(7-8)13(9)5-4-11/h8-10,12H,2-7H2,1H3.
What are the key properties of 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 186.27 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-fluoroethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 130504670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).