1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine

C11H22F3N3 — CID 79328291

IUPAC1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine
SMILESCCN(CCN1CCC(N)CC1)CC(F)(F)F
InChIInChI=1S/C11H22F3N3/c1-2-16(9-11(12,13)14)7-8-17-5-3-10(15)4-6-17/h10H,2-9,15H2,1H3
InChIKeySZKZGLGEGQZQRB-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.29
Rot. Bonds5

About 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine

1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine (PubChem CID 79328291) has the molecular formula C11H22F3N3 and a molecular weight of 253.31 g/mol. Its IUPAC name is 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine
PubChem CID79328291
Molecular FormulaC11H22F3N3
Molecular Weight253.31 g/mol
Exact Mass253.18
IUPAC Name1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine
SMILESCCN(CCN1CCC(N)CC1)CC(F)(F)F
InChIInChI=1S/C11H22F3N3/c1-2-16(9-11(12,13)14)7-8-17-5-3-10(15)4-6-17/h10H,2-9,15H2,1H3
InChIKeySZKZGLGEGQZQRB-UHFFFAOYSA-N
XLogP1.29
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]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 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine?
The IUPAC name of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine (CID 79328291) is 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine?
The canonical SMILES for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine is CCN(CCN1CCC(N)CC1)CC(F)(F)F.
What is the InChIKey of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine?
The InChIKey is SZKZGLGEGQZQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F3N3/c1-2-16(9-11(12,13)14)7-8-17-5-3-10(15)4-6-17/h10H,2-9,15H2,1H3.
What are the key properties of 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine?
1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine has a molecular weight of 253.31 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]piperidin-4-amine is sourced from PubChem (CID 79328291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).