4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine

C11H20N4O5 — CID 104568131

IUPAC4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine
SMILESCOCCOCCOCCOc1nc(N)nc(OC)n1
InChIInChI=1S/C11H20N4O5/c1-16-3-4-18-5-6-19-7-8-20-11-14-9(12)13-10(15-11)17-2/h3-8H2,1-2H3,(H2,12,13,14,15)
InChIKeyNUJJYFHREZMCNL-UHFFFAOYSA-N
MW288.30 g/mol
LogP-0.48
Rot. Bonds11

About 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine

4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine (PubChem CID 104568131) has the molecular formula C11H20N4O5 and a molecular weight of 288.30 g/mol. Its IUPAC name is 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine
PubChem CID104568131
Molecular FormulaC11H20N4O5
Molecular Weight288.30 g/mol
Exact Mass288.14
IUPAC Name4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine
SMILESCOCCOCCOCCOc1nc(N)nc(OC)n1
InChIInChI=1S/C11H20N4O5/c1-16-3-4-18-5-6-19-7-8-20-11-14-9(12)13-10(15-11)17-2/h3-8H2,1-2H3,(H2,12,13,14,15)
InChIKeyNUJJYFHREZMCNL-UHFFFAOYSA-N
XLogP-0.48
TPSA110.84 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine (CID 104568131) is 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine is COCCOCCOCCOc1nc(N)nc(OC)n1.
What is the InChIKey of 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine?
The InChIKey is NUJJYFHREZMCNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O5/c1-16-3-4-18-5-6-19-7-8-20-11-14-9(12)13-10(15-11)17-2/h3-8H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine?
4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine has a molecular weight of 288.30 g/mol, XLogP of -0.48, 11 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine is sourced from PubChem (CID 104568131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).