butane;carbanide;tungsten(2+);yttrium

C9H21WY- — CID 167712375

IUPACbutane;carbanide;tungsten(2+);yttrium
SMILES[CH2-]CCC.[CH2-]CCC.[CH3-].[W+2].[Y]
InChIInChI=1S/2C4H9.CH3.W.Y/c2*1-3-4-2;;;/h2*1,3-4H2,2H3;1H3;;/q3*-1;+2;
InChIKeyDCGUUBXQKJYOHK-UHFFFAOYSA-N
MW402.01 g/mol
LogP3.69
Rot. Bonds2

About butane;carbanide;tungsten(2+);yttrium

butane;carbanide;tungsten(2+);yttrium (PubChem CID 167712375) has the molecular formula C9H21WY- and a molecular weight of 402.01 g/mol. Its IUPAC name is butane;carbanide;tungsten(2+);yttrium.

Molecular Properties

Compound Namebutane;carbanide;tungsten(2+);yttrium
PubChem CID167712375
Molecular FormulaC9H21WY-
Molecular Weight402.01 g/mol
Exact Mass402.02
IUPAC Namebutane;carbanide;tungsten(2+);yttrium
SMILES[CH2-]CCC.[CH2-]CCC.[CH3-].[W+2].[Y]
InChIInChI=1S/2C4H9.CH3.W.Y/c2*1-3-4-2;;;/h2*1,3-4H2,2H3;1H3;;/q3*-1;+2;
InChIKeyDCGUUBXQKJYOHK-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.01
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze butane;carbanide;tungsten(2+);yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

magnesium;butane;carbanide
CID 59738430
butane;cadmium(2+);chloride
CID 22477088
butane;carbanide;iron(3+)
CID 150229735
magnesium;butane;chloride
CID 6101660
butane;carbanide;zirconium(4+)
CID 154094622
butane;zirconium(4+);dichloride
CID 87374724
butane;propane;yttrium
CID 59895294
butane;phosphane;ruthenium(4+);chloride
CID 88846853
butane;nickel
CID 57419181
butane;platinum(2+)
CID 85439871
butane;terbium(3+)
CID 21057379
butane;tris(rubidium(1+))
CID 59203345

Frequently Asked Questions

What is the IUPAC name of butane;carbanide;tungsten(2+);yttrium?
The IUPAC name of butane;carbanide;tungsten(2+);yttrium (CID 167712375) is butane;carbanide;tungsten(2+);yttrium.
What is the SMILES notation for butane;carbanide;tungsten(2+);yttrium?
The canonical SMILES for butane;carbanide;tungsten(2+);yttrium is [CH2-]CCC.[CH2-]CCC.[CH3-].[W+2].[Y].
What is the InChIKey of butane;carbanide;tungsten(2+);yttrium?
The InChIKey is DCGUUBXQKJYOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H9.CH3.W.Y/c2*1-3-4-2;;;/h2*1,3-4H2,2H3;1H3;;/q3*-1;+2;.
What are the key properties of butane;carbanide;tungsten(2+);yttrium?
butane;carbanide;tungsten(2+);yttrium has a molecular weight of 402.01 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;carbanide;tungsten(2+);yttrium is sourced from PubChem (CID 167712375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).