N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

C15H28F3N3 — CID 43791782

IUPACN-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC(CN1CCCCC1)NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C15H28F3N3/c1-13(11-20-7-3-2-4-8-20)19-14-5-9-21(10-6-14)12-15(16,17)18/h13-14,19H,2-12H2,1H3
InChIKeySDNQRNJTPZMBIX-UHFFFAOYSA-N
MW307.40 g/mol
LogP2.48
Rot. Bonds5

About N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (PubChem CID 43791782) has the molecular formula C15H28F3N3 and a molecular weight of 307.40 g/mol. Its IUPAC name is N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
PubChem CID43791782
Molecular FormulaC15H28F3N3
Molecular Weight307.40 g/mol
Exact Mass307.22
IUPAC NameN-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC(CN1CCCCC1)NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C15H28F3N3/c1-13(11-20-7-3-2-4-8-20)19-14-5-9-21(10-6-14)12-15(16,17)18/h13-14,19H,2-12H2,1H3
InChIKeySDNQRNJTPZMBIX-UHFFFAOYSA-N
XLogP2.48
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (CID 43791782) is N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.
What is the SMILES notation for N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The canonical SMILES for N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is CC(CN1CCCCC1)NC1CCN(CC(F)(F)F)CC1.
What is the InChIKey of N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The InChIKey is SDNQRNJTPZMBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28F3N3/c1-13(11-20-7-3-2-4-8-20)19-14-5-9-21(10-6-14)12-15(16,17)18/h13-14,19H,2-12H2,1H3.
What are the key properties of N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine has a molecular weight of 307.40 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-1-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is sourced from PubChem (CID 43791782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).