carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium

C7H8N4WY — CID 91865803

IUPACcarbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium
SMILESCc1nc2ccn[c-]n2n1.[CH3-].[W+2].[Y]
InChIInChI=1S/C6H5N4.CH3.W.Y/c1-5-8-6-2-3-7-4-10(6)9-5;;;/h2-3H,1H3;1H3;;/q2*-1;+2;
InChIKeyFNEMAWMISKJPSA-UHFFFAOYSA-N
MW420.92 g/mol
LogP0.68
Rot. Bonds

About carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium

carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium (PubChem CID 91865803) has the molecular formula C7H8N4WY and a molecular weight of 420.92 g/mol. Its IUPAC name is carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium.

Molecular Properties

Compound Namecarbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium
PubChem CID91865803
Molecular FormulaC7H8N4WY
Molecular Weight420.92 g/mol
Exact Mass420.93
IUPAC Namecarbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium
SMILESCc1nc2ccn[c-]n2n1.[CH3-].[W+2].[Y]
InChIInChI=1S/C6H5N4.CH3.W.Y/c1-5-8-6-2-3-7-4-10(6)9-5;;;/h2-3H,1H3;1H3;;/q2*-1;+2;
InChIKeyFNEMAWMISKJPSA-UHFFFAOYSA-N
XLogP0.68
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.92
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-ethenyl-5H-[1,2,4]triazolo[1,5-c]pyrimidine
CID 68709462
1,5-Bis(ethenyl)-3-methyl-1,2,4-triazole
CID 70225297
carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium
CID 91867234
9-Methyl-1,4,8,10-tetrazabicyclo[5.3.0]deca-2,4,5,7,9-pentaene
CID 126658836
N-[(Z)-2-(2,5-dimethyl-1,2,4-triazol-3-yl)ethenyl]methanimine
CID 126658881
N-[(Z)-2-(2-methyl-1,2,4-triazol-3-yl)ethenyl]methanimine
CID 132062339
1,5-Bis(ethenyl)-3-methyl-1,2,4-triazole;ethane
CID 144069583
ethane;5-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 144122647
5-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 144122648
1,5-Bis(ethenyl)-3-methyl-1,2,4-triazole;ethane
CID 145327278
8-Methyl-2lambda3-ioda-1,3,7,9-tetrazabicyclo[4.3.0]nona-2,4,6,8-tetraene
CID 163625271
3,4-Bis(ethenyl)-5-methyl-1,2,4-triazole
CID 145001585

Frequently Asked Questions

What is the IUPAC name of carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium?
The IUPAC name of carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium (CID 91865803) is carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium.
What is the SMILES notation for carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium?
The canonical SMILES for carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium is Cc1nc2ccn[c-]n2n1.[CH3-].[W+2].[Y].
What is the InChIKey of carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium?
The InChIKey is FNEMAWMISKJPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N4.CH3.W.Y/c1-5-8-6-2-3-7-4-10(6)9-5;;;/h2-3H,1H3;1H3;;/q2*-1;+2;.
What are the key properties of carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium?
carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium has a molecular weight of 420.92 g/mol, XLogP of 0.68, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium is sourced from PubChem (CID 91865803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).