[(4-aminophenyl)-(methylamino)methylidene]tungsten

C8H10N2W — CID 58496499

IUPAC[(4-aminophenyl)-(methylamino)methylidene]tungsten
SMILESCNC(=[W])c1ccc(N)cc1
InChIInChI=1S/C8H10N2.W/c1-10-6-7-2-4-8(9)5-3-7;/h2-5,10H,9H2,1H3;
InChIKeyQPHKPYDGKOFVEF-UHFFFAOYSA-N
MW318.02 g/mol
LogP0.51
Rot. Bonds2

About [(4-aminophenyl)-(methylamino)methylidene]tungsten

[(4-aminophenyl)-(methylamino)methylidene]tungsten (PubChem CID 58496499) has the molecular formula C8H10N2W and a molecular weight of 318.02 g/mol. Its IUPAC name is [(4-aminophenyl)-(methylamino)methylidene]tungsten.

Molecular Properties

Compound Name[(4-aminophenyl)-(methylamino)methylidene]tungsten
PubChem CID58496499
Molecular FormulaC8H10N2W
Molecular Weight318.02 g/mol
Exact Mass318.04
IUPAC Name[(4-aminophenyl)-(methylamino)methylidene]tungsten
SMILESCNC(=[W])c1ccc(N)cc1
InChIInChI=1S/C8H10N2.W/c1-10-6-7-2-4-8(9)5-3-7;/h2-5,10H,9H2,1H3;
InChIKeyQPHKPYDGKOFVEF-UHFFFAOYSA-N
XLogP0.51
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.02
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-aminophenyl)-N-methylbenzamide
CID 91665695
4-(4-aminophenoxy)-N-methylbenzamide
CID 131636828
4-(1-methoxyethenyl)aniline
CID 67566303
4-aminobenzamide;methanol
CID 144801245
4-[(Z)-1-aminoprop-1-enyl]aniline
CID 145170483
4-amino-N'-ethyl-N-hydroxybenzenecarboximidamide
CID 123383430
4-amino-N-methylbenzamide;N-methyl-4-nitrobenzamide
CID 91087652
benzene-1,4-diamine;ethane;methane
CID 159498580
methyl 4-[(4-aminophenyl)methyl]benzoate
CID 68972848
[amino-(4-aminophenyl)methylidene]azanium
CID 3289295
benzene-1,4-diamine;methane
CID 158825195
benzene-1,4-diamine;nickel
CID 87271840

Frequently Asked Questions

What is the IUPAC name of [(4-aminophenyl)-(methylamino)methylidene]tungsten?
The IUPAC name of [(4-aminophenyl)-(methylamino)methylidene]tungsten (CID 58496499) is [(4-aminophenyl)-(methylamino)methylidene]tungsten.
What is the SMILES notation for [(4-aminophenyl)-(methylamino)methylidene]tungsten?
The canonical SMILES for [(4-aminophenyl)-(methylamino)methylidene]tungsten is CNC(=[W])c1ccc(N)cc1.
What is the InChIKey of [(4-aminophenyl)-(methylamino)methylidene]tungsten?
The InChIKey is QPHKPYDGKOFVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.W/c1-10-6-7-2-4-8(9)5-3-7;/h2-5,10H,9H2,1H3;.
What are the key properties of [(4-aminophenyl)-(methylamino)methylidene]tungsten?
[(4-aminophenyl)-(methylamino)methylidene]tungsten has a molecular weight of 318.02 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-aminophenyl)-(methylamino)methylidene]tungsten is sourced from PubChem (CID 58496499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).