carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium

C8H9N3WY — CID 91867234

IUPACcarbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium
SMILESCc1nnc2[c-]cccn12.[CH3-].[W+2].[Y]
InChIInChI=1S/C7H6N3.CH3.W.Y/c1-6-8-9-7-4-2-3-5-10(6)7;;;/h2-3,5H,1H3;1H3;;/q2*-1;+2;
InChIKeyXSWMBBFGMGQSLO-UHFFFAOYSA-N
MW419.93 g/mol
LogP1.28
Rot. Bonds

About carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium

carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium (PubChem CID 91867234) has the molecular formula C8H9N3WY and a molecular weight of 419.93 g/mol. Its IUPAC name is carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium.

Molecular Properties

Compound Namecarbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium
PubChem CID91867234
Molecular FormulaC8H9N3WY
Molecular Weight419.93 g/mol
Exact Mass419.94
IUPAC Namecarbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium
SMILESCc1nnc2[c-]cccn12.[CH3-].[W+2].[Y]
InChIInChI=1S/C7H6N3.CH3.W.Y/c1-6-8-9-7-4-2-3-5-10(6)7;;;/h2-3,5H,1H3;1H3;;/q2*-1;+2;
InChIKeyXSWMBBFGMGQSLO-UHFFFAOYSA-N
XLogP1.28
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.93
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,4-diethyl-5-[(E)-prop-1-enyl]-1,2,4-triazole
CID 57189602
CID 59806643
CID 59806643
carbanide;2-methyl-5H-[1,2,4]triazolo[1,5-c]pyrimidin-5-ide;tungsten(2+);yttrium
CID 91865803
3-ethenyl-5-methyl-4-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 118674639
3,4-bis[(Z)-prop-1-enyl]-1,2,4-triazole
CID 132156357
3-methyl-4-[(1Z,3Z)-penta-1,3-dienyl]-1,2,4-triazole
CID 132185214
3-[(1Z)-buta-1,3-dienyl]-4-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 142875293
4-[(1Z)-buta-1,3-dienyl]-3,5-dimethyl-1,2,4-triazole
CID 143048748
5-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 144122648
Lawrencium;10-methyl-1,8,9-triazabicyclo[5.3.0]deca-2,3,5,7,9-pentaene
CID 144708005
ethane;4-ethenyl-3-methyl-5-[(Z)-prop-1-enyl]-1,2,4-triazole
CID 144708189
4-[(Z)-but-1-enyl]-3-ethenyl-5-methyl-1,2,4-triazole
CID 145001439

Frequently Asked Questions

What is the IUPAC name of carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium?
The IUPAC name of carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium (CID 91867234) is carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium.
What is the SMILES notation for carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium?
The canonical SMILES for carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium is Cc1nnc2[c-]cccn12.[CH3-].[W+2].[Y].
What is the InChIKey of carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium?
The InChIKey is XSWMBBFGMGQSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N3.CH3.W.Y/c1-6-8-9-7-4-2-3-5-10(6)7;;;/h2-3,5H,1H3;1H3;;/q2*-1;+2;.
What are the key properties of carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium?
carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium has a molecular weight of 419.93 g/mol, XLogP of 1.28, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3-methyl-8H-[1,2,4]triazolo[4,3-a]pyridin-8-ide;tungsten(2+);yttrium is sourced from PubChem (CID 91867234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).