3,5-dichloro-1-ethylpyrazin-2-one;vanadium

C6H6Cl2N2OV — CID 159153644

IUPAC3,5-dichloro-1-ethylpyrazin-2-one;vanadium
SMILESCCn1cc(Cl)nc(Cl)c1=O.[V]
InChIInChI=1S/C6H6Cl2N2O.V/c1-2-10-3-4(7)9-5(8)6(10)11;/h3H,2H2,1H3;
InChIKeyKJPRBIDWOYPPTP-UHFFFAOYSA-N
MW243.98 g/mol
LogP1.57
Rot. Bonds1

About 3,5-dichloro-1-ethylpyrazin-2-one;vanadium

3,5-dichloro-1-ethylpyrazin-2-one;vanadium (PubChem CID 159153644) has the molecular formula C6H6Cl2N2OV and a molecular weight of 243.98 g/mol. Its IUPAC name is 3,5-dichloro-1-ethylpyrazin-2-one;vanadium.

Molecular Properties

Compound Name3,5-dichloro-1-ethylpyrazin-2-one;vanadium
PubChem CID159153644
Molecular FormulaC6H6Cl2N2OV
Molecular Weight243.98 g/mol
Exact Mass242.93
IUPAC Name3,5-dichloro-1-ethylpyrazin-2-one;vanadium
SMILESCCn1cc(Cl)nc(Cl)c1=O.[V]
InChIInChI=1S/C6H6Cl2N2O.V/c1-2-10-3-4(7)9-5(8)6(10)11;/h3H,2H2,1H3;
InChIKeyKJPRBIDWOYPPTP-UHFFFAOYSA-N
XLogP1.57
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.98
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-1-ethylpyrazin-2-one;vanadium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-1-ethylpyrazin-2-one;vanadium?
The IUPAC name of 3,5-dichloro-1-ethylpyrazin-2-one;vanadium (CID 159153644) is 3,5-dichloro-1-ethylpyrazin-2-one;vanadium.
What is the SMILES notation for 3,5-dichloro-1-ethylpyrazin-2-one;vanadium?
The canonical SMILES for 3,5-dichloro-1-ethylpyrazin-2-one;vanadium is CCn1cc(Cl)nc(Cl)c1=O.[V].
What is the InChIKey of 3,5-dichloro-1-ethylpyrazin-2-one;vanadium?
The InChIKey is KJPRBIDWOYPPTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Cl2N2O.V/c1-2-10-3-4(7)9-5(8)6(10)11;/h3H,2H2,1H3;.
What are the key properties of 3,5-dichloro-1-ethylpyrazin-2-one;vanadium?
3,5-dichloro-1-ethylpyrazin-2-one;vanadium has a molecular weight of 243.98 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-1-ethylpyrazin-2-one;vanadium is sourced from PubChem (CID 159153644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).