potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium

C5H7KN2O3WY-2 — CID 58639684

IUPACpotassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium
SMILESC[C-]=O.[K+].[NH-]C(=O)CN[C-]=O.[W].[Y]
InChIInChI=1S/C3H5N2O2.C2H3O.K.W.Y/c4-3(7)1-5-2-6;1-2-3;;;/h1H2,(H3,4,5,6,7);1H3;;;/q2*-1;+1;;/p-1
InChIKeyQKAJMMBTEKWYNA-UHFFFAOYSA-M
MW454.97 g/mol
LogP-3.66
Rot. Bonds3

About potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium

potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium (PubChem CID 58639684) has the molecular formula C5H7KN2O3WY-2 and a molecular weight of 454.97 g/mol. Its IUPAC name is potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium.

Molecular Properties

Compound Namepotassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium
PubChem CID58639684
Molecular FormulaC5H7KN2O3WY-2
Molecular Weight454.97 g/mol
Exact Mass454.87
IUPAC Namepotassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium
SMILESC[C-]=O.[K+].[NH-]C(=O)CN[C-]=O.[W].[Y]
InChIInChI=1S/C3H5N2O2.C2H3O.K.W.Y/c4-3(7)1-5-2-6;1-2-3;;;/h1H2,(H3,4,5,6,7);1H3;;;/q2*-1;+1;;/p-1
InChIKeyQKAJMMBTEKWYNA-UHFFFAOYSA-M
XLogP-3.66
TPSA87.04 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.97
LogP ≤ 5-3.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

potassium;hydroxymethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium
CID 59171030
ethanone;(methylaminomethylamino)methanone;yttrium
CID 147459243
fermium;[[2-(oxomethylamino)acetyl]amino]methyl acetate
CID 168986451
methylazanide;pentane-2,4-dione;yttrium
CID 158650555
copper(1+);ethanone;propan-2-one
CID 87381643
carbanide;ethylaminomethanone;tungsten(2+)
CID 21334677
carbanide;ethane;ethylaminomethanone;methane;bis(yttrium)
CID 158310887
chromium(3+);ethane;ethanone
CID 174976009
(propylamino)methanone;tungsten
CID 176938719
butane;ethanone;tungsten;yttrium
CID 158462675
methoxycarbonylazanide;yttrium
CID 59294691
propanoylazanide;rhenium
CID 155738125

Frequently Asked Questions

What is the IUPAC name of potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium?
The IUPAC name of potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium (CID 58639684) is potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium.
What is the SMILES notation for potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium?
The canonical SMILES for potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium is C[C-]=O.[K+].[NH-]C(=O)CN[C-]=O.[W].[Y].
What is the InChIKey of potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium?
The InChIKey is QKAJMMBTEKWYNA-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H5N2O2.C2H3O.K.W.Y/c4-3(7)1-5-2-6;1-2-3;;;/h1H2,(H3,4,5,6,7);1H3;;;/q2*-1;+1;;/p-1.
What are the key properties of potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium?
potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium has a molecular weight of 454.97 g/mol, XLogP of -3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;ethanone;[2-(oxomethylamino)acetyl]azanide;tungsten;yttrium is sourced from PubChem (CID 58639684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).