ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))

C11H11N2Rb3 — CID 156726542

IUPACethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))
SMILESCC.Cc1[c-]c2[c-]n[c-]cc2nc1.[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C9H5N2.C2H6.3Rb/c1-7-4-8-6-10-3-2-9(8)11-5-7;1-2;;;/h2,5H,1H3;1-2H3;;;/q-3;;3*+1
InChIKeyIFEKLZREEZPLHM-UHFFFAOYSA-N
MW427.63 g/mol
LogP-6.62
Rot. Bonds

About ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))

ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)) (PubChem CID 156726542) has the molecular formula C11H11N2Rb3 and a molecular weight of 427.63 g/mol. Its IUPAC name is ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)).

Molecular Properties

Compound Nameethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))
PubChem CID156726542
Molecular FormulaC11H11N2Rb3
Molecular Weight427.63 g/mol
Exact Mass425.83
IUPAC Nameethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))
SMILESCC.Cc1[c-]c2[c-]n[c-]cc2nc1.[Rb+].[Rb+].[Rb+]
InChIInChI=1S/C9H5N2.C2H6.3Rb/c1-7-4-8-6-10-3-2-9(8)11-5-7;1-2;;;/h2,5H,1H3;1-2H3;;;/q-3;;3*+1
InChIKeyIFEKLZREEZPLHM-UHFFFAOYSA-N
XLogP-6.62
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.63
LogP ≤ 5-6.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))?
The IUPAC name of ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)) (CID 156726542) is ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)).
What is the SMILES notation for ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))?
The canonical SMILES for ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)) is CC.Cc1[c-]c2[c-]n[c-]cc2nc1.[Rb+].[Rb+].[Rb+].
What is the InChIKey of ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))?
The InChIKey is IFEKLZREEZPLHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5N2.C2H6.3Rb/c1-7-4-8-6-10-3-2-9(8)11-5-7;1-2;;;/h2,5H,1H3;1-2H3;;;/q-3;;3*+1.
What are the key properties of ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+))?
ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)) has a molecular weight of 427.63 g/mol, XLogP of -6.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-5,7-dihydro-4H-1,6-naphthyridine-4,5,7-triide;tris(rubidium(1+)) is sourced from PubChem (CID 156726542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).