2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine

C11H15F3N4 — CID 10106660

IUPAC2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
SMILESFC(F)(F)CNc1cccnc1N1CCNCC1
InChIInChI=1S/C11H15F3N4/c12-11(13,14)8-17-9-2-1-3-16-10(9)18-6-4-15-5-7-18/h1-3,15,17H,4-8H2
InChIKeyDZSIOHQZIKDXBV-UHFFFAOYSA-N
MW260.26 g/mol
LogP1.47
Rot. Bonds3

About 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine

2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine (PubChem CID 10106660) has the molecular formula C11H15F3N4 and a molecular weight of 260.26 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
PubChem CID10106660
Molecular FormulaC11H15F3N4
Molecular Weight260.26 g/mol
Exact Mass260.12
IUPAC Name2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
SMILESFC(F)(F)CNc1cccnc1N1CCNCC1
InChIInChI=1S/C11H15F3N4/c12-11(13,14)8-17-9-2-1-3-16-10(9)18-6-4-15-5-7-18/h1-3,15,17H,4-8H2
InChIKeyDZSIOHQZIKDXBV-UHFFFAOYSA-N
XLogP1.47
TPSA40.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The IUPAC name of 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine (CID 10106660) is 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine.
What is the SMILES notation for 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The canonical SMILES for 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine is FC(F)(F)CNc1cccnc1N1CCNCC1.
What is the InChIKey of 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The InChIKey is DZSIOHQZIKDXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4/c12-11(13,14)8-17-9-2-1-3-16-10(9)18-6-4-15-5-7-18/h1-3,15,17H,4-8H2.
What are the key properties of 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine has a molecular weight of 260.26 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)pyridin-3-amine is sourced from PubChem (CID 10106660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).