bis[2-(diethylamino)ethyl]azanide;vanadium

C12H28N3V- — CID 147184537

IUPACbis[2-(diethylamino)ethyl]azanide;vanadium
SMILESCCN(CC)CC[N-]CCN(CC)CC.[V]
InChIInChI=1S/C12H28N3.V/c1-5-14(6-2)11-9-13-10-12-15(7-3)8-4;/h5-12H2,1-4H3;/q-1;
InChIKeyAQEHLLXVIJUOCT-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.04
Rot. Bonds10

About bis[2-(diethylamino)ethyl]azanide;vanadium

bis[2-(diethylamino)ethyl]azanide;vanadium (PubChem CID 147184537) has the molecular formula C12H28N3V- and a molecular weight of 265.32 g/mol. Its IUPAC name is bis[2-(diethylamino)ethyl]azanide;vanadium.

Molecular Properties

Compound Namebis[2-(diethylamino)ethyl]azanide;vanadium
PubChem CID147184537
Molecular FormulaC12H28N3V-
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Namebis[2-(diethylamino)ethyl]azanide;vanadium
SMILESCCN(CC)CC[N-]CCN(CC)CC.[V]
InChIInChI=1S/C12H28N3.V/c1-5-14(6-2)11-9-13-10-12-15(7-3)8-4;/h5-12H2,1-4H3;/q-1;
InChIKeyAQEHLLXVIJUOCT-UHFFFAOYSA-N
XLogP2.04
TPSA20.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis[2-(diethylamino)ethyl]azanide;vanadium?
The IUPAC name of bis[2-(diethylamino)ethyl]azanide;vanadium (CID 147184537) is bis[2-(diethylamino)ethyl]azanide;vanadium.
What is the SMILES notation for bis[2-(diethylamino)ethyl]azanide;vanadium?
The canonical SMILES for bis[2-(diethylamino)ethyl]azanide;vanadium is CCN(CC)CC[N-]CCN(CC)CC.[V].
What is the InChIKey of bis[2-(diethylamino)ethyl]azanide;vanadium?
The InChIKey is AQEHLLXVIJUOCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N3.V/c1-5-14(6-2)11-9-13-10-12-15(7-3)8-4;/h5-12H2,1-4H3;/q-1;.
What are the key properties of bis[2-(diethylamino)ethyl]azanide;vanadium?
bis[2-(diethylamino)ethyl]azanide;vanadium has a molecular weight of 265.32 g/mol, XLogP of 2.04, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-(diethylamino)ethyl]azanide;vanadium is sourced from PubChem (CID 147184537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).