2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine

C14H26F3N3 — CID 83009533

IUPAC2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine
SMILESCC1CCCC(C)N1NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C14H26F3N3/c1-11-4-3-5-12(2)20(11)18-13-6-8-19(9-7-13)10-14(15,16)17/h11-13,18H,3-10H2,1-2H3
InChIKeyQMXPPDHKRHBHDW-UHFFFAOYSA-N
MW293.38 g/mol
LogP2.78
Rot. Bonds3

About 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine

2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine (PubChem CID 83009533) has the molecular formula C14H26F3N3 and a molecular weight of 293.38 g/mol. Its IUPAC name is 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine
PubChem CID83009533
Molecular FormulaC14H26F3N3
Molecular Weight293.38 g/mol
Exact Mass293.21
IUPAC Name2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine
SMILESCC1CCCC(C)N1NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C14H26F3N3/c1-11-4-3-5-12(2)20(11)18-13-6-8-19(9-7-13)10-14(15,16)17/h11-13,18H,3-10H2,1-2H3
InChIKeyQMXPPDHKRHBHDW-UHFFFAOYSA-N
XLogP2.78
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine (CID 83009533) is 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine is CC1CCCC(C)N1NC1CCN(CC(F)(F)F)CC1.
What is the InChIKey of 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine?
The InChIKey is QMXPPDHKRHBHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3N3/c1-11-4-3-5-12(2)20(11)18-13-6-8-19(9-7-13)10-14(15,16)17/h11-13,18H,3-10H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine?
2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine has a molecular weight of 293.38 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine is sourced from PubChem (CID 83009533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).