[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten

C5H6NW- — CID 23540342

IUPAC[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten
SMILES[H]/[C-]=N/C=C\C(C)=[W]
InChIInChI=1S/C5H6N.W/c1-3-4-5-6-2;/h2,4-5H,1H3;/q-1;/b5-4-;
InChIKeyLTBJDQNCRIRXCG-MKWAYWHRSA-N
MW263.95 g/mol
LogP0.82
Rot. Bonds2

About [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten

[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten (PubChem CID 23540342) has the molecular formula C5H6NW- and a molecular weight of 263.95 g/mol. Its IUPAC name is [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten.

Molecular Properties

Compound Name[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten
PubChem CID23540342
Molecular FormulaC5H6NW-
Molecular Weight263.95 g/mol
Exact Mass264.00
IUPAC Name[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten
SMILES[H]/[C-]=N/C=C\C(C)=[W]
InChIInChI=1S/C5H6N.W/c1-3-4-5-6-2;/h2,4-5H,1H3;/q-1;/b5-4-;
InChIKeyLTBJDQNCRIRXCG-MKWAYWHRSA-N
XLogP0.82
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.95
LogP ≤ 50.82
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'}

Analyze [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten 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

ethylidenetungsten;1-(methylamino)prop-2-enylidenetungsten
CID 59665904
potassium N-methylmethanimine
CID 58153045
(3Z)-2-methylpenta-1,3-diene;yttrium
CID 58172805
N-but-2-en-2-ylmethanimine;uranium;vanadium
CID 59967511
2,3-dimethylbuta-1,3-diene;pentakis(yttrium)
CID 58460586
aminomethylidenetungsten;1-ethoxyprop-2-enylidenetungsten
CID 59737785
ethylidenetungsten;1-hydroxyprop-2-enylidenetungsten;propane;yttrium
CID 58978278
CID 173311646
CID 173311646
(Z)-4-N-propan-2-ylidenebut-3-ene-2,4-diimine
CID 130413517
bis(2-methylbuta-1,3-diene);nickel(2+)
CID 173162838
(Z)-N',2-dimethylbut-2-ene-1,4-diimine
CID 167038959
3-methylpent-3-en-2-ylidenetungsten
CID 23389049

Frequently Asked Questions

What is the IUPAC name of [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten?
The IUPAC name of [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten (CID 23540342) is [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten.
What is the SMILES notation for [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten?
The canonical SMILES for [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten is [H]/[C-]=N/C=C\C(C)=[W].
What is the InChIKey of [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten?
The InChIKey is LTBJDQNCRIRXCG-MKWAYWHRSA-N. The full InChI is InChI=1S/C5H6N.W/c1-3-4-5-6-2;/h2,4-5H,1H3;/q-1;/b5-4-;.
What are the key properties of [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten?
[(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten has a molecular weight of 263.95 g/mol, XLogP of 0.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-4-(methanidylideneamino)but-3-en-2-ylidene]tungsten is sourced from PubChem (CID 23540342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).