(4-amino-4-iminobut-2-enylidene)tungsten

C4H6N2W — CID 158073297

IUPAC(4-amino-4-iminobut-2-enylidene)tungsten
SMILES[H]/N=C(\N)C=CC=[W]
InChIInChI=1S/C4H6N2.W/c1-2-3-4(5)6;/h1-3H,(H3,5,6);
InChIKeyJWUSAFIEYNWISY-UHFFFAOYSA-N
MW265.95 g/mol
LogP-0.17
Rot. Bonds2

About (4-amino-4-iminobut-2-enylidene)tungsten

(4-amino-4-iminobut-2-enylidene)tungsten (PubChem CID 158073297) has the molecular formula C4H6N2W and a molecular weight of 265.95 g/mol. Its IUPAC name is (4-amino-4-iminobut-2-enylidene)tungsten.

Molecular Properties

Compound Name(4-amino-4-iminobut-2-enylidene)tungsten
PubChem CID158073297
Molecular FormulaC4H6N2W
Molecular Weight265.95 g/mol
Exact Mass266.00
IUPAC Name(4-amino-4-iminobut-2-enylidene)tungsten
SMILES[H]/N=C(\N)C=CC=[W]
InChIInChI=1S/C4H6N2.W/c1-2-3-4(5)6;/h1-3H,(H3,5,6);
InChIKeyJWUSAFIEYNWISY-UHFFFAOYSA-N
XLogP-0.17
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.95
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(Z)-4-amino-4-iminobut-2-enylidene]tungsten
CID 58783188
penta-2,4-dienimidamide
CID 141285400
pent-2-enimidamide
CID 74821450
[(Z)-4-amino-4-azanidylidenebut-2-enylidene]tungsten
CID 58783187
(Z)-3-(cyanomethylamino)prop-2-enimidamide
CID 167310395
(Z)-4-imino-4-phenylbut-2-enimidamide
CID 143937504
carbamimidoyl iodide;hydron
CID 174864753
(E)-3-(2,6-difluorophenyl)prop-2-enimidamide
CID 131242918
2-[[(Z)-3-amino-3-iminoprop-1-enyl]amino]-2-methylpropanamide
CID 146481527
(E)-4-(3H-inden-1-yl)but-2-enimidamide
CID 58171204
(E)-3-(2,5-difluorophenyl)prop-2-enimidamide
CID 131235312
3-hydroxy-2,2-bis(hydroxymethyl)propanimidamide
CID 151214089

Frequently Asked Questions

What is the IUPAC name of (4-amino-4-iminobut-2-enylidene)tungsten?
The IUPAC name of (4-amino-4-iminobut-2-enylidene)tungsten (CID 158073297) is (4-amino-4-iminobut-2-enylidene)tungsten.
What is the SMILES notation for (4-amino-4-iminobut-2-enylidene)tungsten?
The canonical SMILES for (4-amino-4-iminobut-2-enylidene)tungsten is [H]/N=C(\N)C=CC=[W].
What is the InChIKey of (4-amino-4-iminobut-2-enylidene)tungsten?
The InChIKey is JWUSAFIEYNWISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2.W/c1-2-3-4(5)6;/h1-3H,(H3,5,6);.
What are the key properties of (4-amino-4-iminobut-2-enylidene)tungsten?
(4-amino-4-iminobut-2-enylidene)tungsten has a molecular weight of 265.95 g/mol, XLogP of -0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-4-iminobut-2-enylidene)tungsten is sourced from PubChem (CID 158073297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).