lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide

C41H55LiN10O9 — CID 160977570

About lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide

lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide (PubChem CID 160977570) has the molecular formula C41H55LiN10O9 and a molecular weight of 838.89 g/mol. Its IUPAC name is lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide.

Molecular Properties

• Compound Name: lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide
• PubChem CID: 160977570
• Molecular Formula: C41H55LiN10O9
• Molecular Weight: 838.89 g/mol
• Exact Mass: 838.43
• IUPAC Name: lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide
• SMILES: CCOC(=O)C(CC(C)=O)=NOC.CCOC(=O)c1cc(C)nn1-c1cc(C)cc(C)n1.Cc1cc(C)nc(-n2nc(C)cc2C(=O)O)c1.Cc1cc(C)nc(NN)c1.[Li+].[OH-]
• InChI: InChI=1S/C14H17N3O2.C12H13N3O2.C8H13NO4.C7H11N3.Li.H2O/c1-5-19-14(18)12-8-11(4)16-17(12)13-7-9(2)6-10(3)15-13;1-7-4-8(2)13-11(5-7)15-10(12(16)17)6-9(3)14-15;1-4-13-8(11)7(9-12-3)5-6(2)10;1-5-3-6(2)9-7(4-5)10-8;;/h6-8H,5H2,1-4H3;4-6H,1-3H3,(H,16,17);4-5H2,1-3H3;3-4H,8H2,1-2H3,(H,9,10);;1H2/q;;;;+1;/p-1
• InChIKey: SZBPFABEGSFFMT-UHFFFAOYSA-M
• XLogP: 2.60
• TPSA: 270.92 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 18
• Rotatable Bonds: 11
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	838.89
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide?

The IUPAC name of lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide (CID 160977570) is lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide.

What is the SMILES notation for lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide?

The canonical SMILES for lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide is CCOC(=O)C(CC(C)=O)=NOC.CCOC(=O)c1cc(C)nn1-c1cc(C)cc(C)n1.Cc1cc(C)nc(-n2nc(C)cc2C(=O)O)c1.Cc1cc(C)nc(NN)c1.[Li+].[OH-].

What is the InChIKey of lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide?

The InChIKey is SZBPFABEGSFFMT-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H17N3O2.C12H13N3O2.C8H13NO4.C7H11N3.Li.H2O/c1-5-19-14(18)12-8-11(4)16-17(12)13-7-9(2)6-10(3)15-13;1-7-4-8(2)13-11(5-7)15-10(12(16)17)6-9(3)14-15;1-4-13-8(11)7(9-12-3)5-6(2)10;1-5-3-6(2)9-7(4-5)10-8;;/h6-8H,5H2,1-4H3;4-6H,1-3H3,(H,16,17);4-5H2,1-3H3;3-4H,8H2,1-2H3,(H,9,10);;1H2/q;;;;+1;/p-1.

What are the key properties of lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide?

lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide has a molecular weight of 838.89 g/mol, XLogP of 2.60, 11 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;(4,6-dimethyl-2-pyridinyl)hydrazine;2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylic acid;ethyl 2-(4,6-dimethyl-2-pyridinyl)-5-methylpyrazole-3-carboxylate;ethyl 2-methoxyimino-4-oxopentanoate;hydroxide is sourced from PubChem (CID 160977570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).