ethane;5-methyl-2H-pyridin-2-ide;vanadium

C8H12NV- — CID 166117577

IUPACethane;5-methyl-2H-pyridin-2-ide;vanadium
SMILESCC.Cc1cc[c-]nc1.[V]
InChIInChI=1S/C6H6N.C2H6.V/c1-6-3-2-4-7-5-6;1-2;/h2-3,5H,1H3;1-2H3;/q-1;;
InChIKeyGIDWJUNRUDCQOZ-UHFFFAOYSA-N
MW173.13 g/mol
LogP2.21
Rot. Bonds

About ethane;5-methyl-2H-pyridin-2-ide;vanadium

ethane;5-methyl-2H-pyridin-2-ide;vanadium (PubChem CID 166117577) has the molecular formula C8H12NV- and a molecular weight of 173.13 g/mol. Its IUPAC name is ethane;5-methyl-2H-pyridin-2-ide;vanadium.

Molecular Properties

Compound Nameethane;5-methyl-2H-pyridin-2-ide;vanadium
PubChem CID166117577
Molecular FormulaC8H12NV-
Molecular Weight173.13 g/mol
Exact Mass173.04
IUPAC Nameethane;5-methyl-2H-pyridin-2-ide;vanadium
SMILESCC.Cc1cc[c-]nc1.[V]
InChIInChI=1S/C6H6N.C2H6.V/c1-6-3-2-4-7-5-6;1-2;/h2-3,5H,1H3;1-2H3;/q-1;;
InChIKeyGIDWJUNRUDCQOZ-UHFFFAOYSA-N
XLogP2.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.13
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-methyl-2H-pyridin-2-ide;vanadium
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5-methyl-2H-pyridin-2-ide;N-(oxomethyl)propanamide;tungsten
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zinc;5-fluoro-2H-pyridin-2-ide;bromide
CID 86612379
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ethane;4-methylpyridine
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methylbenzene;zirconium
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CID 158807312

Frequently Asked Questions

What is the IUPAC name of ethane;5-methyl-2H-pyridin-2-ide;vanadium?
The IUPAC name of ethane;5-methyl-2H-pyridin-2-ide;vanadium (CID 166117577) is ethane;5-methyl-2H-pyridin-2-ide;vanadium.
What is the SMILES notation for ethane;5-methyl-2H-pyridin-2-ide;vanadium?
The canonical SMILES for ethane;5-methyl-2H-pyridin-2-ide;vanadium is CC.Cc1cc[c-]nc1.[V].
What is the InChIKey of ethane;5-methyl-2H-pyridin-2-ide;vanadium?
The InChIKey is GIDWJUNRUDCQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N.C2H6.V/c1-6-3-2-4-7-5-6;1-2;/h2-3,5H,1H3;1-2H3;/q-1;;.
What are the key properties of ethane;5-methyl-2H-pyridin-2-ide;vanadium?
ethane;5-methyl-2H-pyridin-2-ide;vanadium has a molecular weight of 173.13 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methyl-2H-pyridin-2-ide;vanadium is sourced from PubChem (CID 166117577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).