2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine

C16H27N5O2 — CID 70882626

IUPAC2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine
SMILESCc1nc(OC2CCN(C)CC2)nc(OC2CCN(C)CC2)n1
InChIInChI=1S/C16H27N5O2/c1-12-17-15(22-13-4-8-20(2)9-5-13)19-16(18-12)23-14-6-10-21(3)11-7-14/h13-14H,4-11H2,1-3H3
InChIKeyPOCNKQIGRUXSJG-UHFFFAOYSA-N
MW321.43 g/mol
LogP1.13
Rot. Bonds4

About 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine

2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine (PubChem CID 70882626) has the molecular formula C16H27N5O2 and a molecular weight of 321.43 g/mol. Its IUPAC name is 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine.

Molecular Properties

Compound Name2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine
PubChem CID70882626
Molecular FormulaC16H27N5O2
Molecular Weight321.43 g/mol
Exact Mass321.22
IUPAC Name2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine
SMILESCc1nc(OC2CCN(C)CC2)nc(OC2CCN(C)CC2)n1
InChIInChI=1S/C16H27N5O2/c1-12-17-15(22-13-4-8-20(2)9-5-13)19-16(18-12)23-14-6-10-21(3)11-7-14/h13-14H,4-11H2,1-3H3
InChIKeyPOCNKQIGRUXSJG-UHFFFAOYSA-N
XLogP1.13
TPSA63.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-[4-(4-Hydroxypiperidin-1-yl)-6-methyl-1,3,5-triazin-2-yl]piperidin-4-ol
CID 58012611
4-(4-Methyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
CID 89903045
4-(4-Methyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine;molecular hydrogen
CID 161777249
2-Chloro-4-(1-methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazine
CID 62870163
4-(1-Methylpiperidin-4-yl)oxy-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80879712
4-(2-Methoxyethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 101077268
N,N-dimethyl-4-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]-6-propan-2-yl-1,3,5-triazin-2-amine
CID 133420011
4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 133434243

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine?
The IUPAC name of 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine (CID 70882626) is 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine.
What is the SMILES notation for 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine?
The canonical SMILES for 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine is Cc1nc(OC2CCN(C)CC2)nc(OC2CCN(C)CC2)n1.
What is the InChIKey of 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine?
The InChIKey is POCNKQIGRUXSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O2/c1-12-17-15(22-13-4-8-20(2)9-5-13)19-16(18-12)23-14-6-10-21(3)11-7-14/h13-14H,4-11H2,1-3H3.
What are the key properties of 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine?
2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine has a molecular weight of 321.43 g/mol, XLogP of 1.13, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,6-bis[(1-methylpiperidin-4-yl)oxy]-1,3,5-triazine is sourced from PubChem (CID 70882626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).