4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine

C14H24N6O — CID 80879712

IUPAC4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCN1CCC(Oc2nc(N)nc(N3CCCCC3)n2)CC1
InChIInChI=1S/C14H24N6O/c1-19-9-5-11(6-10-19)21-14-17-12(15)16-13(18-14)20-7-3-2-4-8-20/h11H,2-10H2,1H3,(H2,15,16,17,18)
InChIKeyLZFFUHGCSBSMRM-UHFFFAOYSA-N
MW292.39 g/mol
LogP0.92
Rot. Bonds3

About 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine

4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 80879712) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID80879712
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCN1CCC(Oc2nc(N)nc(N3CCCCC3)n2)CC1
InChIInChI=1S/C14H24N6O/c1-19-9-5-11(6-10-19)21-14-17-12(15)16-13(18-14)20-7-3-2-4-8-20/h11H,2-10H2,1H3,(H2,15,16,17,18)
InChIKeyLZFFUHGCSBSMRM-UHFFFAOYSA-N
XLogP0.92
TPSA80.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 80879712) is 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine is CN1CCC(Oc2nc(N)nc(N3CCCCC3)n2)CC1.
What is the InChIKey of 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is LZFFUHGCSBSMRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-19-9-5-11(6-10-19)21-14-17-12(15)16-13(18-14)20-7-3-2-4-8-20/h11H,2-10H2,1H3,(H2,15,16,17,18).
What are the key properties of 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 292.39 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80879712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).