[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten

C10H10ClN3W — CID 59852435

IUPAC[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten
SMILESC=N/C(Cl)=N\C(=[W])N(C)c1ccccc1
InChIInChI=1S/C10H10ClN3.W/c1-12-10(11)13-8-14(2)9-6-4-3-5-7-9;/h3-7H,1H2,2H3;/b13-10-;
InChIKeyWGRPYIWUCSZRNC-ALUHPYBCSA-N
MW391.50 g/mol
LogP2.05
Rot. Bonds3

About [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten

[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten (PubChem CID 59852435) has the molecular formula C10H10ClN3W and a molecular weight of 391.50 g/mol. Its IUPAC name is [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten.

Molecular Properties

Compound Name[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten
PubChem CID59852435
Molecular FormulaC10H10ClN3W
Molecular Weight391.50 g/mol
Exact Mass391.01
IUPAC Name[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten
SMILESC=N/C(Cl)=N\C(=[W])N(C)c1ccccc1
InChIInChI=1S/C10H10ClN3.W/c1-12-10(11)13-8-14(2)9-6-4-3-5-7-9;/h3-7H,1H2,2H3;/b13-10-;
InChIKeyWGRPYIWUCSZRNC-ALUHPYBCSA-N
XLogP2.05
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.50
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten?
The IUPAC name of [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten (CID 59852435) is [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten.
What is the SMILES notation for [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten?
The canonical SMILES for [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten is C=N/C(Cl)=N\C(=[W])N(C)c1ccccc1.
What is the InChIKey of [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten?
The InChIKey is WGRPYIWUCSZRNC-ALUHPYBCSA-N. The full InChI is InChI=1S/C10H10ClN3.W/c1-12-10(11)13-8-14(2)9-6-4-3-5-7-9;/h3-7H,1H2,2H3;/b13-10-;.
What are the key properties of [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten?
[[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten has a molecular weight of 391.50 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[(E)-[chloro-(methylideneamino)methylidene]amino]-(N-methylanilino)methylidene]tungsten is sourced from PubChem (CID 59852435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).