diethylaminomethylidynetungsten(1+)

C5H10NW+ — CID 12057847

IUPACdiethylaminomethylidynetungsten(1+)
SMILESCCN(C#[W+])CC
InChIInChI=1S/C5H10N.W/c1-4-6(3)5-2;/h4-5H2,1-2H3;/q;+1
InChIKeyKPUSITOCAHGMFL-UHFFFAOYSA-N
MW267.98 g/mol
LogP0.79
Rot. Bonds2

About diethylaminomethylidynetungsten(1+)

diethylaminomethylidynetungsten(1+) (PubChem CID 12057847) has the molecular formula C5H10NW+ and a molecular weight of 267.98 g/mol. Its IUPAC name is diethylaminomethylidynetungsten(1+).

Molecular Properties

Compound Namediethylaminomethylidynetungsten(1+)
PubChem CID12057847
Molecular FormulaC5H10NW+
Molecular Weight267.98 g/mol
Exact Mass268.03
IUPAC Namediethylaminomethylidynetungsten(1+)
SMILESCCN(C#[W+])CC
InChIInChI=1S/C5H10N.W/c1-4-6(3)5-2;/h4-5H2,1-2H3;/q;+1
InChIKeyKPUSITOCAHGMFL-UHFFFAOYSA-N
XLogP0.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.98
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

diethylcyanamide
CID 12050
CID 53355529
CID 53355529
diethylamino(oxo)azanium
CID 139032465
N,N-dimethylmethanamine;propane
CID 159726621
N,N-diethylpent-3-en-1-yn-1-amine
CID 58421834
4-(diethylamino)but-3-ynenitrile
CID 135266637
N,N-diethylprop-1-yn-1-amine;sulfuric acid
CID 71383833
ethane;N-ethyl-N-methylethanamine;propane
CID 170620045
N,N-dipropylpropan-1-amine;propane
CID 174574210
methane;propane
CID 160994941
propane trihydroxide
CID 18172989
propane;ruthenium
CID 161061794

Frequently Asked Questions

What is the IUPAC name of diethylaminomethylidynetungsten(1+)?
The IUPAC name of diethylaminomethylidynetungsten(1+) (CID 12057847) is diethylaminomethylidynetungsten(1+).
What is the SMILES notation for diethylaminomethylidynetungsten(1+)?
The canonical SMILES for diethylaminomethylidynetungsten(1+) is CCN(C#[W+])CC.
What is the InChIKey of diethylaminomethylidynetungsten(1+)?
The InChIKey is KPUSITOCAHGMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N.W/c1-4-6(3)5-2;/h4-5H2,1-2H3;/q;+1.
What are the key properties of diethylaminomethylidynetungsten(1+)?
diethylaminomethylidynetungsten(1+) has a molecular weight of 267.98 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethylaminomethylidynetungsten(1+) is sourced from PubChem (CID 12057847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).