2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine

C12H24N6O3 — CID 58031155

IUPAC2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine
SMILESCOCN(C)c1nc(N(C)COC)nc(N(C)COC)n1
InChIInChI=1S/C12H24N6O3/c1-16(7-19-4)10-13-11(17(2)8-20-5)15-12(14-10)18(3)9-21-6/h7-9H2,1-6H3
InChIKeyUYNDCIXRLSVBTI-UHFFFAOYSA-N
MW300.36 g/mol
LogP-0.01
Rot. Bonds9

About 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine

2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 58031155) has the molecular formula C12H24N6O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine
PubChem CID58031155
Molecular FormulaC12H24N6O3
Molecular Weight300.36 g/mol
Exact Mass300.19
IUPAC Name2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine
SMILESCOCN(C)c1nc(N(C)COC)nc(N(C)COC)n1
InChIInChI=1S/C12H24N6O3/c1-16(7-19-4)10-13-11(17(2)8-20-5)15-12(14-10)18(3)9-21-6/h7-9H2,1-6H3
InChIKeyUYNDCIXRLSVBTI-UHFFFAOYSA-N
XLogP-0.01
TPSA76.08 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine (CID 58031155) is 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine is COCN(C)c1nc(N(C)COC)nc(N(C)COC)n1.
What is the InChIKey of 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is UYNDCIXRLSVBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N6O3/c1-16(7-19-4)10-13-11(17(2)8-20-5)15-12(14-10)18(3)9-21-6/h7-9H2,1-6H3.
What are the key properties of 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine?
2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 300.36 g/mol, XLogP of -0.01, 9 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,6-N-tris(methoxymethyl)-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 58031155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).