1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium

C10H10N2WY-2 — CID 59708837

IUPAC1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium
SMILES[3H][C-]1C(=C)N(C)c2c[c-]nc(C)c21.[W].[Y]
InChIInChI=1S/C10H10N2.W.Y/c1-7-6-9-8(2)11-5-4-10(9)12(7)3;;/h4,6H,1H2,2-3H3;;/q-2;;/i6T;;
InChIKeyXQLDDXKRJZSXHI-JFCUDOESSA-N
MW432.96 g/mol
LogP1.70
Rot. Bonds

About 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium

1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium (PubChem CID 59708837) has the molecular formula C10H10N2WY-2 and a molecular weight of 432.96 g/mol. Its IUPAC name is 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium.

Molecular Properties

Compound Name1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium
PubChem CID59708837
Molecular FormulaC10H10N2WY-2
Molecular Weight432.96 g/mol
Exact Mass432.95
IUPAC Name1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium
SMILES[3H][C-]1C(=C)N(C)c2c[c-]nc(C)c21.[W].[Y]
InChIInChI=1S/C10H10N2.W.Y/c1-7-6-9-8(2)11-5-4-10(9)12(7)3;;/h4,6H,1H2,2-3H3;;/q-2;;/i6T;;
InChIKeyXQLDDXKRJZSXHI-JFCUDOESSA-N
XLogP1.70
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.96
LogP ≤ 51.70
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 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium?
The IUPAC name of 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium (CID 59708837) is 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium.
What is the SMILES notation for 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium?
The canonical SMILES for 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium is [3H][C-]1C(=C)N(C)c2c[c-]nc(C)c21.[W].[Y].
What is the InChIKey of 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium?
The InChIKey is XQLDDXKRJZSXHI-JFCUDOESSA-N. The full InChI is InChI=1S/C10H10N2.W.Y/c1-7-6-9-8(2)11-5-4-10(9)12(7)3;;/h4,6H,1H2,2-3H3;;/q-2;;/i6T;;.
What are the key properties of 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium?
1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium has a molecular weight of 432.96 g/mol, XLogP of 1.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-methylidene-3-tritio-6H-pyrrolo[3,2-c]pyridine-3,6-diide;tungsten;yttrium is sourced from PubChem (CID 59708837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).