1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine

C8H15F3N2 — CID 82399659

IUPAC1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine
SMILESCN1CC(N)CCC1CC(F)(F)F
InChIInChI=1S/C8H15F3N2/c1-13-5-6(12)2-3-7(13)4-8(9,10)11/h6-7H,2-5,12H2,1H3
InChIKeyIADDNMUIAPNCDV-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.36
Rot. Bonds1

About 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine

1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine (PubChem CID 82399659) has the molecular formula C8H15F3N2 and a molecular weight of 196.22 g/mol. Its IUPAC name is 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine.

Molecular Properties

Compound Name1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine
PubChem CID82399659
Molecular FormulaC8H15F3N2
Molecular Weight196.22 g/mol
Exact Mass196.12
IUPAC Name1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine
SMILESCN1CC(N)CCC1CC(F)(F)F
InChIInChI=1S/C8H15F3N2/c1-13-5-6(12)2-3-7(13)4-8(9,10)11/h6-7H,2-5,12H2,1H3
InChIKeyIADDNMUIAPNCDV-UHFFFAOYSA-N
XLogP1.36
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine?
The IUPAC name of 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine (CID 82399659) is 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine.
What is the SMILES notation for 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine?
The canonical SMILES for 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine is CN1CC(N)CCC1CC(F)(F)F.
What is the InChIKey of 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine?
The InChIKey is IADDNMUIAPNCDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2/c1-13-5-6(12)2-3-7(13)4-8(9,10)11/h6-7H,2-5,12H2,1H3.
What are the key properties of 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine?
1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine has a molecular weight of 196.22 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-(2,2,2-trifluoroethyl)piperidin-3-amine is sourced from PubChem (CID 82399659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).