2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine

C11H15N3O4 — CID 138591652

IUPAC2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine
SMILESC=CCOc1nc(OCC=C)nc(OCOC)n1
InChIInChI=1S/C11H15N3O4/c1-4-6-16-9-12-10(17-7-5-2)14-11(13-9)18-8-15-3/h4-5H,1-2,6-8H2,3H3
InChIKeyUVLOIYSKQJXOIS-UHFFFAOYSA-N
MW253.26 g/mol
LogP0.98
Rot. Bonds9

About 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine

2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine (PubChem CID 138591652) has the molecular formula C11H15N3O4 and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine
PubChem CID138591652
Molecular FormulaC11H15N3O4
Molecular Weight253.26 g/mol
Exact Mass253.11
IUPAC Name2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine
SMILESC=CCOc1nc(OCC=C)nc(OCOC)n1
InChIInChI=1S/C11H15N3O4/c1-4-6-16-9-12-10(17-7-5-2)14-11(13-9)18-8-15-3/h4-5H,1-2,6-8H2,3H3
InChIKeyUVLOIYSKQJXOIS-UHFFFAOYSA-N
XLogP0.98
TPSA75.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Triallyl cyanurate
CID 7555
2,4-Bis(allyloxy)-6-chloro-1,3,5-triazine
CID 84514
4-Allyloxy-6-methoxy-N,N-dimethyl-1,3,5-triazin-2-amine
CID 610855
2,4-Dimethoxy-6-allyloxy-sym-triazine
CID 13141333
2,4-Diallyloxy-6-t-butylperoxy-1,3,5-triazine
CID 20029046
4,6-Bis(allyloxy)-2-methoxy-1,3,5-triazine
CID 6452248
2,4-Bis(tert-butylperoxy)-6-prop-2-enoxy-1,3,5-triazine
CID 20029048
[4,6-Bis(prop-2-enoxy)-1,3,5-triazin-2-yl] ethyl carbonate
CID 20268121
2,4-Diethoxy-6-prop-2-enoxy-1,3,5-triazine
CID 21489715
2-Ethoxy-4,6-bis(prop-2-enoxy)-1,3,5-triazine
CID 22628792
[4,6-Bis(prop-2-enoxycarbonyloxy)-1,3,5-triazin-2-yl] prop-2-enyl carbonate
CID 23322605
2,4,6-Tris(but-2-enoxy)-1,3,5-triazine
CID 54247427

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine?
The IUPAC name of 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine (CID 138591652) is 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine.
What is the SMILES notation for 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine?
The canonical SMILES for 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine is C=CCOc1nc(OCC=C)nc(OCOC)n1.
What is the InChIKey of 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine?
The InChIKey is UVLOIYSKQJXOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4/c1-4-6-16-9-12-10(17-7-5-2)14-11(13-9)18-8-15-3/h4-5H,1-2,6-8H2,3H3.
What are the key properties of 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine?
2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine has a molecular weight of 253.26 g/mol, XLogP of 0.98, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxy)-4,6-bis(prop-2-enoxy)-1,3,5-triazine is sourced from PubChem (CID 138591652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).