methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine

C9H15N3O6Rf3-6 — CID 59099776

IUPACmethanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine
SMILES[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]Oc1nc(O[CH2-])nc(O[CH2-])n1.[Rf].[Rf].[Rf]
InChIInChI=1S/C6H6N3O3.3CH3O.3Rf/c1-10-4-7-5(11-2)9-6(8-4)12-3;3*1-2;;;/h1-3H2;3*2H,1H2;;;/q-3;3*-1;;;
InChIKeyDMFVEPUDGSQCQO-UHFFFAOYSA-N
MW1062.23 g/mol
LogP0.83
Rot. Bonds3

About methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine

methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine (PubChem CID 59099776) has the molecular formula C9H15N3O6Rf3-6 and a molecular weight of 1062.23 g/mol. Its IUPAC name is methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine.

Molecular Properties

Compound Namemethanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine
PubChem CID59099776
Molecular FormulaC9H15N3O6Rf3-6
Molecular Weight1062.23 g/mol
Exact Mass1062.46
IUPAC Namemethanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine
SMILES[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]Oc1nc(O[CH2-])nc(O[CH2-])n1.[Rf].[Rf].[Rf]
InChIInChI=1S/C6H6N3O3.3CH3O.3Rf/c1-10-4-7-5(11-2)9-6(8-4)12-3;3*1-2;;;/h1-3H2;3*2H,1H2;;;/q-3;3*-1;;;
InChIKeyDMFVEPUDGSQCQO-UHFFFAOYSA-N
XLogP0.83
TPSA127.05 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001062.23
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

Hexamethylolmelamine
CID 62361
((4,6-Bis(bis(methoxymethyl)amino)-1,3,5-triazin-2-yl)(methoxymethyl)amino)methanol
CID 83757
2,4,6-Trimethoxy-1,3,5-triazine
CID 13419
Hmmm TP363
CID 20318181
Hmmm TP349
CID 20484942
Methanol, 1,1',1'',1''',1'''',1'''''-(1,3,5-triazine-2,4,6-triyltrinitrilo)hexakis-, trimethyl ether
CID 57603619
(4,6-Dimethoxy-1,3,5-triazin-2-yl)oxyboronic acid
CID 134954843
[[4,6-Bis[bis(hydroxymethyl)amino]-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol;hydrate
CID 18431955
[4,6-Bis(hydroxymethoxy)-1,3,5-triazin-2-yl]oxymethanol
CID 19855688
[[4-[Bis(hydroxymethyl)amino]-6-[bis(methoxymethyl)amino]-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
CID 20371865
[[4-[Bis(hydroxymethyl)amino]-6-[hydroxymethyl(methoxymethyl)amino]-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol
CID 20371866
[[4,6-Bis[bis(hydroxymethyl)amino]-1,3,5-triazin-2-yl]-(hydroxymethyl)amino]methanol;methoxymethane
CID 20474075

Frequently Asked Questions

What is the IUPAC name of methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine?
The IUPAC name of methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine (CID 59099776) is methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine.
What is the SMILES notation for methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine?
The canonical SMILES for methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine is [CH2-]O.[CH2-]O.[CH2-]O.[CH2-]Oc1nc(O[CH2-])nc(O[CH2-])n1.[Rf].[Rf].[Rf].
What is the InChIKey of methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine?
The InChIKey is DMFVEPUDGSQCQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N3O3.3CH3O.3Rf/c1-10-4-7-5(11-2)9-6(8-4)12-3;3*1-2;;;/h1-3H2;3*2H,1H2;;;/q-3;3*-1;;;.
What are the key properties of methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine?
methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine has a molecular weight of 1062.23 g/mol, XLogP of 0.83, 3 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;tris(rutherfordium);2,4,6-trimethanidyloxy-1,3,5-triazine is sourced from PubChem (CID 59099776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).