N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine

C10H21FN2 — CID 80696333

IUPACN-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
SMILESCN(CCF)CCC1CCCCN1
InChIInChI=1S/C10H21FN2/c1-13(9-6-11)8-5-10-4-2-3-7-12-10/h10,12H,2-9H2,1H3
InChIKeyJXXNEXXXVIJSPU-UHFFFAOYSA-N
MW188.29 g/mol
LogP1.42
Rot. Bonds5

About N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine

N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine (PubChem CID 80696333) has the molecular formula C10H21FN2 and a molecular weight of 188.29 g/mol. Its IUPAC name is N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
PubChem CID80696333
Molecular FormulaC10H21FN2
Molecular Weight188.29 g/mol
Exact Mass188.17
IUPAC NameN-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
SMILESCN(CCF)CCC1CCCCN1
InChIInChI=1S/C10H21FN2/c1-13(9-6-11)8-5-10-4-2-3-7-12-10/h10,12H,2-9H2,1H3
InChIKeyJXXNEXXXVIJSPU-UHFFFAOYSA-N
XLogP1.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine?
The IUPAC name of N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine (CID 80696333) is N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine.
What is the SMILES notation for N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine?
The canonical SMILES for N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine is CN(CCF)CCC1CCCCN1.
What is the InChIKey of N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine?
The InChIKey is JXXNEXXXVIJSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2/c1-13(9-6-11)8-5-10-4-2-3-7-12-10/h10,12H,2-9H2,1H3.
What are the key properties of N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine?
N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine has a molecular weight of 188.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine is sourced from PubChem (CID 80696333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).