[(Z)-4-amino-4-iminobut-2-enylidene]vanadium

C4H6N2V — CID 164709767

IUPAC[(Z)-4-amino-4-iminobut-2-enylidene]vanadium
SMILES[H]/N=C(N)/C=C\C=[V]
InChIInChI=1S/C4H6N2.V/c1-2-3-4(5)6;/h1-3H,(H3,5,6);/b3-2-;
InChIKeyLQPXPFCMJSDHBE-OLGQORCHSA-N
MW133.05 g/mol
LogP-0.17
Rot. Bonds2

About [(Z)-4-amino-4-iminobut-2-enylidene]vanadium

[(Z)-4-amino-4-iminobut-2-enylidene]vanadium (PubChem CID 164709767) has the molecular formula C4H6N2V and a molecular weight of 133.05 g/mol. Its IUPAC name is [(Z)-4-amino-4-iminobut-2-enylidene]vanadium.

Molecular Properties

Compound Name[(Z)-4-amino-4-iminobut-2-enylidene]vanadium
PubChem CID164709767
Molecular FormulaC4H6N2V
Molecular Weight133.05 g/mol
Exact Mass133.00
IUPAC Name[(Z)-4-amino-4-iminobut-2-enylidene]vanadium
SMILES[H]/N=C(N)/C=C\C=[V]
InChIInChI=1S/C4H6N2.V/c1-2-3-4(5)6;/h1-3H,(H3,5,6);/b3-2-;
InChIKeyLQPXPFCMJSDHBE-OLGQORCHSA-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 ≤ 500133.05
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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Frequently Asked Questions

What is the IUPAC name of [(Z)-4-amino-4-iminobut-2-enylidene]vanadium?
The IUPAC name of [(Z)-4-amino-4-iminobut-2-enylidene]vanadium (CID 164709767) is [(Z)-4-amino-4-iminobut-2-enylidene]vanadium.
What is the SMILES notation for [(Z)-4-amino-4-iminobut-2-enylidene]vanadium?
The canonical SMILES for [(Z)-4-amino-4-iminobut-2-enylidene]vanadium is [H]/N=C(N)/C=C\C=[V].
What is the InChIKey of [(Z)-4-amino-4-iminobut-2-enylidene]vanadium?
The InChIKey is LQPXPFCMJSDHBE-OLGQORCHSA-N. The full InChI is InChI=1S/C4H6N2.V/c1-2-3-4(5)6;/h1-3H,(H3,5,6);/b3-2-;.
What are the key properties of [(Z)-4-amino-4-iminobut-2-enylidene]vanadium?
[(Z)-4-amino-4-iminobut-2-enylidene]vanadium has a molecular weight of 133.05 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 [(Z)-4-amino-4-iminobut-2-enylidene]vanadium is sourced from PubChem (CID 164709767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).