carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium

C10H20N2WY-2 — CID 158899137

IUPACcarbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium
SMILESC.[CH3-].[H]/[C-]=C/N=C(\C(=[W])CC)N(C)C.[Y]
InChIInChI=1S/C8H13N2.CH4.CH3.W.Y/c1-5-7-8(9-6-2)10(3)4;;;;/h2,6H,5H2,1,3-4H3;1H4;1H3;;/q-1;;-1;;/b9-8+;;;;
InChIKeyJMKLDQUXEHXWED-HUMMXKGPSA-N
MW441.03 g/mol
LogP2.11
Rot. Bonds3

About carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium

carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium (PubChem CID 158899137) has the molecular formula C10H20N2WY-2 and a molecular weight of 441.03 g/mol. Its IUPAC name is carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium.

Molecular Properties

Compound Namecarbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium
PubChem CID158899137
Molecular FormulaC10H20N2WY-2
Molecular Weight441.03 g/mol
Exact Mass441.02
IUPAC Namecarbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium
SMILESC.[CH3-].[H]/[C-]=C/N=C(\C(=[W])CC)N(C)C.[Y]
InChIInChI=1S/C8H13N2.CH4.CH3.W.Y/c1-5-7-8(9-6-2)10(3)4;;;;/h2,6H,5H2,1,3-4H3;1H4;1H3;;/q-1;;-1;;/b9-8+;;;;
InChIKeyJMKLDQUXEHXWED-HUMMXKGPSA-N
XLogP2.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.03
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-butyl-N-ethenyl-N-methylethanimidamide
CID 129095041
N'-butyl-N-ethenyl-N,2,2-trimethylpropanimidamide
CID 129095407
N'-ethenyl-N,N,2,2-tetramethylpropanimidamide
CID 135181578
N,N'-bis(ethenyl)-N,2,2-trimethylpropanimidamide
CID 139497574
ethane;1-ethenyl-N,3-dimethylpyrazin-2-imine
CID 144307833
[1-(Dimethylamino)-1-ethenyliminopropan-2-ylidene]tungsten;methane
CID 161225829
[1-(Dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium
CID 161606085
1,1-Dimethyl-2-propylimidazol-1-ium
CID 23451454
[1-(Dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten
CID 158899138
[1-(Dimethylamino)-1-ethenyliminopropan-2-ylidene]tungsten
CID 161225830
N-ethenyl-N,N'-dimethylpentanimidamide
CID 166084190

Frequently Asked Questions

What is the IUPAC name of carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium?
The IUPAC name of carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium (CID 158899137) is carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium.
What is the SMILES notation for carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium?
The canonical SMILES for carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium is C.[CH3-].[H]/[C-]=C/N=C(\C(=[W])CC)N(C)C.[Y].
What is the InChIKey of carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium?
The InChIKey is JMKLDQUXEHXWED-HUMMXKGPSA-N. The full InChI is InChI=1S/C8H13N2.CH4.CH3.W.Y/c1-5-7-8(9-6-2)10(3)4;;;;/h2,6H,5H2,1,3-4H3;1H4;1H3;;/q-1;;-1;;/b9-8+;;;;.
What are the key properties of carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium?
carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium has a molecular weight of 441.03 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten;methane;yttrium is sourced from PubChem (CID 158899137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).