2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))

C14H23NV5 — CID 58055665

IUPAC2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
SMILESC[C-](C)C.C[C-](C)C.[CH2-]C1=NC=C[C-]=C1.[V].[V].[V].[V+2].[V+2]
InChIInChI=1S/C6H5N.2C4H9.5V/c1-6-4-2-3-5-7-6;2*1-4(2)3;;;;;/h3-5H,1H2;2*1-3H3;;;;;/q-2;2*-1;;;;2*+2
InChIKeyZMTAKEFVPVXWLC-UHFFFAOYSA-N
MW460.05 g/mol
LogP—
Rot. Bonds

About 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))

2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)) (PubChem CID 58055665) has the molecular formula C14H23NV5 and a molecular weight of 460.05 g/mol. Its IUPAC name is 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)).

Molecular Properties

Compound Name2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
PubChem CID58055665
Molecular FormulaC14H23NV5
Molecular Weight460.05 g/mol
Exact Mass459.90
IUPAC Name2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
SMILESC[C-](C)C.C[C-](C)C.[CH2-]C1=NC=C[C-]=C1.[V].[V].[V].[V+2].[V+2]
InChIInChI=1S/C6H5N.2C4H9.5V/c1-6-4-2-3-5-7-6;2*1-4(2)3;;;;;/h3-5H,1H2;2*1-3H3;;;;;/q-2;2*-1;;;;2*+2
InChIKeyZMTAKEFVPVXWLC-UHFFFAOYSA-N
XLogP—
TPSA12.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity218

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(1Z)-1-Benzazocine
CID 17846319
(3Z,5E)-5-fluoro-N-[(Z)-prop-1-enyl]hepta-3,5-dien-2-imine
CID 144296874
(1E)-N-ethenyl-1-(4-fluorocyclohexa-2,4-dien-1-ylidene)propan-2-imine
CID 155181207
(3E,5Z)-3-fluoro-5-methyl-N-[(Z)-prop-1-enyl]hepta-3,5-dien-2-imine
CID 172361995
Benz[b]azocine
CID 23636810
N-methyl-4-[2-(1-methyl-4-pyridinylidene)ethylidene]cyclohexa-2,5-dien-1-imine
CID 53800904
4-ethyl-2-methyl-3H-pyridin-3-ide;yttrium
CID 57575179
methylbenzene;2-methyl-4H-pyridin-4-ide;yttrium
CID 57961612
4-methanidyl-2H-pyridin-2-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
CID 58055461
5-methanidyl-2H-pyridin-2-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
CID 58055640
6-methanidyl-3H-pyridin-3-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))
CID 58055657
propane;2-propan-2-yl-4H-pyridin-4-ide;vanadium(2+)
CID 58748015

Frequently Asked Questions

What is the IUPAC name of 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))?
The IUPAC name of 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)) (CID 58055665) is 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)).
What is the SMILES notation for 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))?
The canonical SMILES for 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)) is C[C-](C)C.C[C-](C)C.[CH2-]C1=NC=C[C-]=C1.[V].[V].[V].[V+2].[V+2].
What is the InChIKey of 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))?
The InChIKey is ZMTAKEFVPVXWLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N.2C4H9.5V/c1-6-4-2-3-5-7-6;2*1-4(2)3;;;;;/h3-5H,1H2;2*1-3H3;;;;;/q-2;2*-1;;;;2*+2.
What are the key properties of 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+))?
2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)) has a molecular weight of 460.05 g/mol, XLogP of not available, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methanidyl-4H-pyridin-4-ide;bis(2-methylpropane);tris(vanadium);bis(vanadium(2+)) is sourced from PubChem (CID 58055665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).