2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol

C15H26N6O — CID 2188447

IUPAC2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol
SMILESOCCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C15H26N6O/c22-12-7-16-13-17-14(20-8-3-1-4-9-20)19-15(18-13)21-10-5-2-6-11-21/h22H,1-12H2,(H,16,17,18,19)
InChIKeyPEVUCDOBOJYUED-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.26
Rot. Bonds5

About 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol

2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 2188447) has the molecular formula C15H26N6O and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID2188447
Molecular FormulaC15H26N6O
Molecular Weight306.41 g/mol
Exact Mass306.22
IUPAC Name2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol
SMILESOCCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C15H26N6O/c22-12-7-16-13-17-14(20-8-3-1-4-9-20)19-15(18-13)21-10-5-2-6-11-21/h22H,1-12H2,(H,16,17,18,19)
InChIKeyPEVUCDOBOJYUED-UHFFFAOYSA-N
XLogP1.26
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol (CID 2188447) is 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol is OCCNc1nc(N2CCCCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is PEVUCDOBOJYUED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6O/c22-12-7-16-13-17-14(20-8-3-1-4-9-20)19-15(18-13)21-10-5-2-6-11-21/h22H,1-12H2,(H,16,17,18,19).
What are the key properties of 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 306.41 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 2188447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).