carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)

C46H86N23O6V9-9 — CID 159965188

About carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)

carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium) (PubChem CID 159965188) has the molecular formula C46H86N23O6V9-9 and a molecular weight of 1515.84 g/mol. Its IUPAC name is carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium).

Molecular Properties

• Compound Name: carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)
• PubChem CID: 159965188
• Molecular Formula: C46H86N23O6V9-9
• Molecular Weight: 1515.84 g/mol
• Exact Mass: 1515.21
• IUPAC Name: carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)
• SMILES: CC.CN1CCNC1=O.CN1N=CCC1=O.Cc1ccn[nH]1.Cc1ccno1.Cc1cn[nH]c1.Cn1cc[nH]c1=O.Cn1cccn1.Cn1cn[nH]c1=O.Cn1cncn1.Cn1nn[n-]c1=O.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[V].[V].[V].[V].[V].[V].[V].[V].[V]
• InChI: InChI=1S/C4H8N2O.2C4H6N2O.3C4H6N2.C4H5NO.C3H5N3O.C3H5N3.C2H4N4O.C2H6.8CH3.9V/c2*1-6-3-2-5-4(6)7;1-6-4(7)2-3-5-6;1-4-2-5-6-3-4;1-6-4-2-3-5-6;2*1-4-2-3-5-6-4;1-6-2-4-5-3(6)7;1-6-3-4-2-5-6;1-6-2(7)3-4-5-6;1-2;;;;;;;;;;;;;;;;;/h2-3H2,1H3,(H,5,7);2-3H,1H3,(H,5,7);3H,2H2,1H3;2-3H,1H3,(H,5,6);2-4H,1H3;2-3H,1H3,(H,5,6);2-3H,1H3;2H,1H3,(H,5,7);2-3H,1H3;1H3,(H,3,5,7);1-2H3;8*1H3;;;;;;;;;/q;;;;;;;;;;;8*-1;;;;;;;;;/p-1
• InChIKey: ZHQBZSCBJBDCEO-UHFFFAOYSA-M
• XLogP: 3.69
• TPSA: 347.28 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 21
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1515.84
LogP ≤ 5	3.69
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)?

The IUPAC name of carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium) (CID 159965188) is carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium).

What is the SMILES notation for carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)?

The canonical SMILES for carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium) is CC.CN1CCNC1=O.CN1N=CCC1=O.Cc1ccn[nH]1.Cc1ccno1.Cc1cn[nH]c1.Cn1cc[nH]c1=O.Cn1cccn1.Cn1cn[nH]c1=O.Cn1cncn1.Cn1nn[n-]c1=O.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[V].[V].[V].[V].[V].[V].[V].[V].[V].

What is the InChIKey of carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)?

The InChIKey is ZHQBZSCBJBDCEO-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H8N2O.2C4H6N2O.3C4H6N2.C4H5NO.C3H5N3O.C3H5N3.C2H4N4O.C2H6.8CH3.9V/c2*1-6-3-2-5-4(6)7;1-6-4(7)2-3-5-6;1-4-2-5-6-3-4;1-6-4-2-3-5-6;2*1-4-2-3-5-6-4;1-6-2-4-5-3(6)7;1-6-3-4-2-5-6;1-6-2(7)3-4-5-6;1-2;;;;;;;;;;;;;;;;;/h2-3H2,1H3,(H,5,7);2-3H,1H3,(H,5,7);3H,2H2,1H3;2-3H,1H3,(H,5,6);2-4H,1H3;2-3H,1H3,(H,5,6);2-3H,1H3;2H,1H3,(H,5,7);2-3H,1H3;1H3,(H,3,5,7);1-2H3;8*1H3;;;;;;;;;/q;;;;;;;;;;;8*-1;;;;;;;;;/p-1.

What are the key properties of carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium)?

carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium) has a molecular weight of 1515.84 g/mol, XLogP of 3.69, 0 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for carbanide;ethane;1-methylimidazolidin-2-one;3-methyl-1H-imidazol-2-one;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;2-methyl-4H-pyrazol-3-one;1-methyl-1,2,3-triaza-4-azanidacyclopent-2-en-5-one;1-methyl-1,2,4-triazole;4-methyl-1H-1,2,4-triazol-5-one;nonakis(vanadium) is sourced from PubChem (CID 159965188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).