2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine

C14H20F3N5 — CID 638715

IUPAC2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine
SMILESFC(F)(F)c1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C14H20F3N5/c15-14(16,17)11-18-12(21-7-3-1-4-8-21)20-13(19-11)22-9-5-2-6-10-22/h1-10H2
InChIKeyKOVGEMDGSLSNGV-UHFFFAOYSA-N
MW315.34 g/mol
LogP2.87
Rot. Bonds2

About 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine

2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine (PubChem CID 638715) has the molecular formula C14H20F3N5 and a molecular weight of 315.34 g/mol. Its IUPAC name is 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine
PubChem CID638715
Molecular FormulaC14H20F3N5
Molecular Weight315.34 g/mol
Exact Mass315.17
IUPAC Name2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine
SMILESFC(F)(F)c1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C14H20F3N5/c15-14(16,17)11-18-12(21-7-3-1-4-8-21)20-13(19-11)22-9-5-2-6-10-22/h1-10H2
InChIKeyKOVGEMDGSLSNGV-UHFFFAOYSA-N
XLogP2.87
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine?
The IUPAC name of 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine (CID 638715) is 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine?
The canonical SMILES for 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine is FC(F)(F)c1nc(N2CCCCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine?
The InChIKey is KOVGEMDGSLSNGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3N5/c15-14(16,17)11-18-12(21-7-3-1-4-8-21)20-13(19-11)22-9-5-2-6-10-22/h1-10H2.
What are the key properties of 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine?
2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine has a molecular weight of 315.34 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(piperidin-1-yl)-6-(trifluoromethyl)-1,3,5-triazine is sourced from PubChem (CID 638715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).