4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine

C12H19N5O3 — CID 80873023

IUPAC4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
SMILESNc1nc(OC2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O3/c13-10-14-11(17-3-7-19-8-4-17)16-12(15-10)20-9-1-5-18-6-2-9/h9H,1-8H2,(H2,13,14,15,16)
InChIKeyZJZAAXRPGDQNDN-UHFFFAOYSA-N
MW281.32 g/mol
LogP-0.15
Rot. Bonds3

About 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine

4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine (PubChem CID 80873023) has the molecular formula C12H19N5O3 and a molecular weight of 281.32 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
PubChem CID80873023
Molecular FormulaC12H19N5O3
Molecular Weight281.32 g/mol
Exact Mass281.15
IUPAC Name4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
SMILESNc1nc(OC2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O3/c13-10-14-11(17-3-7-19-8-4-17)16-12(15-10)20-9-1-5-18-6-2-9/h9H,1-8H2,(H2,13,14,15,16)
InChIKeyZJZAAXRPGDQNDN-UHFFFAOYSA-N
XLogP-0.15
TPSA95.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4-cyclohexyloxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80858635
4-[4-chloro-6-(oxan-4-yloxy)-1,3,5-triazin-2-yl]morpholine
CID 62869818
4-(2-methylcyclohexyl)oxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80845160
(4-cyclopentyloxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)hydrazine
CID 80909749
[4-(oxan-4-yloxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80911618
4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80872862
4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 82008989
4-hexoxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80862100
4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764187
[1-(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)piperidin-4-yl]methanol
CID 80757087
4-(2-methylmorpholin-4-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764638
2-N,2-N-diethyl-6-(oxan-4-yloxy)-1,3,5-triazine-2,4-diamine
CID 80872901

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine (CID 80873023) is 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine is Nc1nc(OC2CCOCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine?
The InChIKey is ZJZAAXRPGDQNDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O3/c13-10-14-11(17-3-7-19-8-4-17)16-12(15-10)20-9-1-5-18-6-2-9/h9H,1-8H2,(H2,13,14,15,16).
What are the key properties of 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine?
4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine has a molecular weight of 281.32 g/mol, XLogP of -0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80873023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).