4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine

C11H19N5O3 — CID 670835

IUPAC4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NCCN2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H19N5O3/c1-17-10-13-9(14-11(15-10)18-2)12-3-4-16-5-7-19-8-6-16/h3-8H2,1-2H3,(H,12,13,14,15)
InChIKeyGAQFHPJKJRYNCB-UHFFFAOYSA-N
MW269.30 g/mol
LogP-0.37
Rot. Bonds6

About 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine

4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine (PubChem CID 670835) has the molecular formula C11H19N5O3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
PubChem CID670835
Molecular FormulaC11H19N5O3
Molecular Weight269.30 g/mol
Exact Mass269.15
IUPAC Name4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NCCN2CCOCC2)nc(OC)n1
InChIInChI=1S/C11H19N5O3/c1-17-10-13-9(14-11(15-10)18-2)12-3-4-16-5-7-19-8-6-16/h3-8H2,1-2H3,(H,12,13,14,15)
InChIKeyGAQFHPJKJRYNCB-UHFFFAOYSA-N
XLogP-0.37
TPSA81.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine (CID 670835) is 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine is COc1nc(NCCN2CCOCC2)nc(OC)n1.
What is the InChIKey of 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine?
The InChIKey is GAQFHPJKJRYNCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O3/c1-17-10-13-9(14-11(15-10)18-2)12-3-4-16-5-7-19-8-6-16/h3-8H2,1-2H3,(H,12,13,14,15).
What are the key properties of 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine?
4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine has a molecular weight of 269.30 g/mol, XLogP of -0.37, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 670835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).